Natural Product: NPC313304

Natural Product ID:  NPC313304
Common Name:   1-Hydroxy-10,12-Dimethoxy-8-Methyl-4-(3,4,5-Trihydroxy-4,6-Dimethyloxan-2-Yl)Naphtho[1,2-C]Isochromen-6-One
IUPAC Name:   1-hydroxy-10,12-dimethoxy-8-methyl-4-(3,4,5-trihydroxy-4,6-dimethyloxan-2-yl)naphtho[1,2-c]isochromen-6-one
Synonyms:  
Molecular Formula:   C27H28O9
Standard InCHIKey:  BJPYMDSMDBCKEP-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C27H28O9/c1-11-8-15-19(17(9-11)33-4)14-10-18(34-5)21-16(28)7-6-13(20(21)22(14)36-26(15)31)23-25(30)27(3,32)24(29)12(2)35-23/h6-10,12,23-25,28-30,32H,1-5H3
Canonical SMILES:  COc1cc2c(c3c1c(O)ccc3C1OC(C)C(C(C1O)(C)O)O)oc(=O)c1c2c(OC)cc(c1)C
First Find Year:  
Max Developmental Stage:  
Synthetic Gene Cluster:   ;

  Species Source

Organism ID Organism Name Taxonomy Level Family SuperKingdom Isolation Part Collection Location Collection Time Reference
NPO17325 Streptomyces virens Species Streptomycetaceae Bacteria StreptomeDB*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT2 Others Unspecified Potency 5804.8 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 1299.5 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 35481.3 nM PubChem BioAssay data set
NPT8 Individual Protein DNA polymerase iota Homo sapiens Potency 14125.4 nM PubChem BioAssay data set
NPT803 Individual Protein Flap endonuclease 1 Homo sapiens Potency 3548.1 nM PubChem BioAssay data set
NPT9 Individual Protein DNA polymerase eta Homo sapiens Potency 3981.1 nM PubChem BioAssay data set
NPT199 Individual Protein DNA polymerase kappa Homo sapiens Potency 39810.7 nM PubChem BioAssay data set
NPT154 Individual Protein Mothers against decapentaplegic homolog 3 Homo sapiens Potency 7079.5 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 5011.9 nM PubChem BioAssay data set
NPT71 Cell Line HEK293 Homo sapiens Potency 562.3 nM PubChem BioAssay data set
NPT368 Cell Line SN12C Homo sapiens GI50 401.79 nM PubChem BioAssay data set
NPT370 Cell Line NCI-H23 Homo sapiens GI50 223.36 nM PubChem BioAssay data set
NPT371 Cell Line UO-31 Homo sapiens GI50 1037.53 nM PubChem BioAssay data set
NPT372 Cell Line HOP-92 Homo sapiens GI50 744.73 nM PubChem BioAssay data set
NPT116 Cell Line HL-60 Homo sapiens GI50 44.98 nM PubChem BioAssay data set
NPT374 Cell Line SF-539 Homo sapiens GI50 465.59 nM PubChem BioAssay data set
NPT373 Cell Line SK-MEL-5 Homo sapiens GI50 580.76 nM PubChem BioAssay data set
NPT375 Cell Line Malme-3M Homo sapiens GI50 672.98 nM PubChem BioAssay data set
NPT111 Cell Line K562 Homo sapiens GI50 277.33 nM PubChem BioAssay data set
NPT377 Cell Line OVCAR-3 Homo sapiens GI50 785.24 nM PubChem BioAssay data set
NPT376 Cell Line A498 Homo sapiens GI50 464.52 nM PubChem BioAssay data set
NPT112 Cell Line MOLT-4 Homo sapiens GI50 74.99 nM PubChem BioAssay data set
NPT379 Cell Line HOP-62 Homo sapiens GI50 283.79 nM PubChem BioAssay data set
NPT380 Cell Line U-251 Homo sapiens GI50 334.97 nM PubChem BioAssay data set
NPT378 Cell Line NCI/ADR-RES Homo sapiens GI50 622.3 nM PubChem BioAssay data set
NPT381 Cell Line OVCAR-8 Homo sapiens GI50 256.45 nM PubChem BioAssay data set
NPT382 Cell Line OVCAR-5 Homo sapiens GI50 680.77 nM PubChem BioAssay data set
NPT383 Cell Line SNB-19 Homo sapiens GI50 562.34 nM PubChem BioAssay data set
NPT572 Cell Line DMS-273 Homo sapiens GI50 335.74 nM PubChem BioAssay data set
NPT323 Cell Line SW-620 Homo sapiens GI50 311.89 nM PubChem BioAssay data set
NPT573 Cell Line M19-MEL Homo sapiens GI50 706.32 nM PubChem BioAssay data set
NPT455 Cell Line NCI-H522 Homo sapiens GI50 389.05 nM PubChem BioAssay data set
NPT386 Cell Line KM12 Homo sapiens GI50 770.9 nM PubChem BioAssay data set
NPT574 Cell Line XF498 Homo sapiens GI50 369.83 nM PubChem BioAssay data set
NPT388 Cell Line NCI-H322M Homo sapiens GI50 493.17 nM PubChem BioAssay data set
NPT389 Cell Line RPMI-8226 Homo sapiens GI50 453.94 nM PubChem BioAssay data set
NPT456 Cell Line OVCAR-4 Homo sapiens GI50 466.66 nM PubChem BioAssay data set
NPT390 Cell Line LOX IMVI Homo sapiens GI50 319.89 nM PubChem BioAssay data set
NPT168 Cell Line P388 Mus musculus GI50 170.61 nM PubChem BioAssay data set
NPT147 Cell Line SK-MEL-2 Homo sapiens GI50 794.33 nM PubChem BioAssay data set
NPT81 Cell Line A549 Homo sapiens GI50 438.53 nM PubChem BioAssay data set
NPT575 Cell Line KM-20L2 Homo sapiens GI50 663.74 nM PubChem BioAssay data set
NPT392 Cell Line SNB-75 Homo sapiens GI50 571.48 nM PubChem BioAssay data set
NPT391 Cell Line HCC 2998 Homo sapiens GI50 665.27 nM PubChem BioAssay data set
NPT148 Cell Line HCT-15 Homo sapiens GI50 662.22 nM PubChem BioAssay data set
NPT393 Cell Line HCT-116 Homo sapiens GI50 215.77 nM PubChem BioAssay data set
NPT395 Cell Line SF-268 Homo sapiens GI50 349.14 nM PubChem BioAssay data set
NPT394 Cell Line EKVX Homo sapiens GI50 776.25 nM PubChem BioAssay data set
NPT83 Cell Line MCF7 Homo sapiens GI50 236.59 nM PubChem BioAssay data set
NPT576 Cell Line DMS-114 Homo sapiens GI50 314.77 nM PubChem BioAssay data set
NPT146 Cell Line SK-OV-3 Homo sapiens GI50 1177.61 nM PubChem BioAssay data set
NPT398 Cell Line UACC-62 Homo sapiens GI50 414 nM PubChem BioAssay data set
NPT397 Cell Line NCI-H460 Homo sapiens GI50 141.91 nM PubChem BioAssay data set
NPT308 Cell Line CAKI-1 Homo sapiens GI50 431.52 nM PubChem BioAssay data set
NPT552 Cell Line P388/ADR Mus musculus GI50 219.28 nM PubChem BioAssay data set
NPT458 Cell Line IGROV-1 Homo sapiens GI50 814.7 nM PubChem BioAssay data set
NPT399 Cell Line SF-295 Homo sapiens GI50 358.1 nM PubChem BioAssay data set
NPT578 Cell Line SNB-78 Homo sapiens GI50 755.09 nM PubChem BioAssay data set
NPT404 Cell Line CCRF-CEM Homo sapiens GI50 95.5 nM PubChem BioAssay data set
NPT579 Cell Line DLD-1 Homo sapiens GI50 845.28 nM PubChem BioAssay data set
NPT403 Cell Line UACC-257 Homo sapiens GI50 731.14 nM PubChem BioAssay data set
NPT405 Cell Line NCI-H226 Homo sapiens GI50 375.84 nM PubChem BioAssay data set
NPT139 Cell Line HT-29 Homo sapiens GI50 463.45 nM PubChem BioAssay data set
NPT170 Cell Line SK-MEL-28 Homo sapiens GI50 860.99 nM PubChem BioAssay data set
NPT407 Cell Line COLO 205 Homo sapiens GI50 550.81 nM PubChem BioAssay data set
NPT406 Cell Line RXF 393 Homo sapiens GI50 380.19 nM PubChem BioAssay data set
NPT738 Cell Line SN12K1 Homo sapiens GI50 349.14 nM PubChem BioAssay data set
NPT732 Cell Line HOP-18 Homo sapiens GI50 1412.54 nM PubChem BioAssay data set
NPT1797 Individual Protein Alpha trans-inducing protein (VP16) Herpes simplex virus (type 1 / strain 17) IC50 7597 nM PubChem BioAssay data set
NPT1798 Individual Protein Photoreceptor-specific nuclear receptor Homo sapiens IC50 12709 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 7943.3 nM PubChem BioAssay data set
NPT10 Individual Protein Geminin Homo sapiens Potency 7307.8 nM PubChem BioAssay data set
NPT478 Individual Protein Ataxin-2 Homo sapiens Potency 9466.2 nM PubChem BioAssay data set
NPT101 Individual Protein Glucagon-like peptide 1 receptor Homo sapiens Potency 10000 nM PubChem BioAssay data set
NPT821 Individual Protein Werner syndrome ATP-dependent helicase Homo sapiens Potency 22387.2 nM PubChem BioAssay data set
NPT755 Individual Protein Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 Homo sapiens Potency 16944.1 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 29092.9 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1458.1 nM PubChem BioAssay data set
NPT160 Individual Protein TAR DNA-binding protein 43 Homo sapiens Potency 3162.3 nM PubChem BioAssay data set
NPT920 Individual Protein Alpha-synuclein Homo sapiens Potency 6309.6 nM PubChem BioAssay data set
NPT1274 Individual Protein DNA repair protein RAD52 homolog Homo sapiens AC50 = 18850 nM PubChem BioAssay data set
NPT861 Individual Protein Isocitrate dehydrogenase [NADP] cytoplasmic Homo sapiens Potency 25929 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 31622.8 nM PubChem BioAssay data set
NPT2 Others Unspecified IC50 17428 nM PubChem BioAssay data set
NPT9 Individual Protein DNA polymerase eta Homo sapiens Potency 21331.3 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 28183.8 nM PubChem BioAssay data set
NPT152 Individual Protein Nuclear factor erythroid 2-related factor 2 Homo sapiens Potency 1835.6 nM PubChem BioAssay data set
NPT803 Individual Protein Flap endonuclease 1 Homo sapiens Potency 849.2 nM PubChem BioAssay data set
NPT8 Individual Protein DNA polymerase iota Homo sapiens Potency 29934.9 nM PubChem BioAssay data set
NPT5855 Individual Protein E3 ubiquitin-protein ligase UHRF1 Homo sapiens IC50 26719 nM PubChem BioAssay data set

  Similar Natural Products in NPASS

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient

●  The left chart: Distribution of similarity level between NPC313304 and all remaining natural products in the NPASS database.
●  The right table: Most similar natural products (Tc>=0.56 or Top200).

Similarity Score Similarity Level Natural Product ID
0.9181 High Similarity NPC241847
0.8947 High Similarity NPC245059
0.8947 High Similarity NPC84494
0.8941 High Similarity NPC312630
0.8941 High Similarity NPC324220
0.8929 High Similarity NPC52598
0.8929 High Similarity NPC241874
0.8895 High Similarity NPC475161
0.8895 High Similarity NPC53680
0.8895 High Similarity NPC470448
0.8895 High Similarity NPC470452
0.8895 High Similarity NPC164047
0.8895 High Similarity NPC208797
0.8895 High Similarity NPC477860
0.8895 High Similarity NPC470453
0.8882 High Similarity NPC199533
0.8882 High Similarity NPC470454
0.8876 High Similarity NPC212038
0.8876 High Similarity NPC271848
0.8876 High Similarity NPC81332
0.8876 High Similarity NPC262580
0.8876 High Similarity NPC289396
0.8862 High Similarity NPC178173
0.8855 High Similarity NPC67959
0.8837 High Similarity NPC153578
0.8837 High Similarity NPC299149
0.8837 High Similarity NPC277710
0.8837 High Similarity NPC114257
0.883 High Similarity NPC475246
0.883 High Similarity NPC102053
0.8824 High Similarity NPC85368
0.881 High Similarity NPC225419
0.8802 High Similarity NPC142614
0.8795 High Similarity NPC473961
0.8788 High Similarity NPC471976
0.8788 High Similarity NPC24164
0.8786 High Similarity NPC208069
0.8779 High Similarity NPC477682
0.8779 High Similarity NPC477683
0.8772 High Similarity NPC3718
0.8772 High Similarity NPC63105
0.8772 High Similarity NPC68381
0.8772 High Similarity NPC294149
0.8765 High Similarity NPC472620
0.8765 High Similarity NPC477836
0.8758 High Similarity NPC475890
0.875 High Similarity NPC30027
0.8743 High Similarity NPC87583
0.8735 High Similarity NPC3629
0.8735 High Similarity NPC124747
0.8735 High Similarity NPC155754
0.8728 High Similarity NPC473785
0.8728 High Similarity NPC58538
0.8721 High Similarity NPC46958
0.8721 High Similarity NPC297574
0.872 High Similarity NPC146211
0.8713 High Similarity NPC154986
0.8713 High Similarity NPC203751
0.8712 High Similarity NPC477691
0.8706 High Similarity NPC251144
0.8706 High Similarity NPC241387
0.8706 High Similarity NPC298778
0.8698 High Similarity NPC76647
0.8693 High Similarity NPC105591
0.8678 High Similarity NPC125352
0.8675 High Similarity NPC53889
0.8675 High Similarity NPC24627
0.8671 High Similarity NPC207467
0.8667 High Similarity NPC68324
0.8667 High Similarity NPC167098
0.8667 High Similarity NPC114179
0.8667 High Similarity NPC160512
0.8667 High Similarity NPC156818
0.8667 High Similarity NPC296044
0.8667 High Similarity NPC289322
0.8667 High Similarity NPC38779
0.8663 High Similarity NPC470667
0.8655 High Similarity NPC271385
0.8655 High Similarity NPC5029
0.8655 High Similarity NPC65333
0.8655 High Similarity NPC76128
0.8655 High Similarity NPC158226
0.8655 High Similarity NPC111536
0.8655 High Similarity NPC30432
0.865 High Similarity NPC477690
0.8647 High Similarity NPC476279
0.8647 High Similarity NPC99613
0.8647 High Similarity NPC472619
0.8647 High Similarity NPC49487
0.8639 High Similarity NPC477835
0.8639 High Similarity NPC472621
0.8631 High Similarity NPC477689
0.8631 High Similarity NPC17432
0.8629 High Similarity NPC129533
0.8629 High Similarity NPC123259
0.8623 High Similarity NPC139540
0.8623 High Similarity NPC109061
0.8623 High Similarity NPC97812
0.8623 High Similarity NPC177100
0.8614 High Similarity NPC186113
0.8614 High Similarity NPC98083
0.8614 High Similarity NPC37502
0.8614 High Similarity NPC94220
0.8614 High Similarity NPC267627
0.8614 High Similarity NPC166456
0.8614 High Similarity NPC87317
0.8614 High Similarity NPC4950
0.8614 High Similarity NPC24339
0.8614 High Similarity NPC40702
0.8614 High Similarity NPC7543
0.8613 High Similarity NPC67629
0.8613 High Similarity NPC79736
0.8613 High Similarity NPC475233
0.8613 High Similarity NPC289876
0.8606 High Similarity NPC318432
0.8606 High Similarity NPC88803
0.8606 High Similarity NPC78492
0.8606 High Similarity NPC471787
0.8606 High Similarity NPC208152
0.8606 High Similarity NPC104983
0.8606 High Similarity NPC291948
0.8606 High Similarity NPC250436
0.8606 High Similarity NPC300845
0.8605 High Similarity NPC263119
0.8605 High Similarity NPC472054
0.8605 High Similarity NPC34436
0.8605 High Similarity NPC219600
0.8605 High Similarity NPC166674
0.8605 High Similarity NPC98583
0.8605 High Similarity NPC46640
0.8605 High Similarity NPC213052
0.8598 High Similarity NPC474622
0.8598 High Similarity NPC474621
0.8596 High Similarity NPC109827
0.8596 High Similarity NPC314672
0.8596 High Similarity NPC103307
0.8596 High Similarity NPC124470
0.8588 High Similarity NPC14662
0.8588 High Similarity NPC470341
0.8588 High Similarity NPC472622
0.8588 High Similarity NPC474024
0.8588 High Similarity NPC105414
0.8588 High Similarity NPC6588
0.8588 High Similarity NPC473094
0.8588 High Similarity NPC477154
0.8588 High Similarity NPC472058
0.8588 High Similarity NPC117854
0.8588 High Similarity NPC103633
0.8588 High Similarity NPC234497
0.8588 High Similarity NPC234331
0.8588 High Similarity NPC324522
0.858 High Similarity NPC471788
0.858 High Similarity NPC224557
0.858 High Similarity NPC292706
0.858 High Similarity NPC99216
0.858 High Similarity NPC178281
0.858 High Similarity NPC103116
0.8571 High Similarity NPC472402
0.8571 High Similarity NPC8940
0.8571 High Similarity NPC131405
0.8571 High Similarity NPC15374
0.8571 High Similarity NPC216752
0.8563 High Similarity NPC143050
0.8563 High Similarity NPC472387
0.8563 High Similarity NPC470810
0.8563 High Similarity NPC328093
0.8563 High Similarity NPC472055
0.8563 High Similarity NPC267549
0.8563 High Similarity NPC47191
0.8556 High Similarity NPC477082
0.8555 High Similarity NPC98667
0.8555 High Similarity NPC232412
0.8555 High Similarity NPC186800
0.8555 High Similarity NPC474345
0.8555 High Similarity NPC86809
0.8555 High Similarity NPC193377
0.8554 High Similarity NPC247713
0.8554 High Similarity NPC143328
0.8547 High Similarity NPC473113
0.8547 High Similarity NPC292712
0.8547 High Similarity NPC100251
0.8547 High Similarity NPC264302
0.8547 High Similarity NPC312006
0.8547 High Similarity NPC474075
0.8547 High Similarity NPC471921
0.8547 High Similarity NPC20114
0.8547 High Similarity NPC114550
0.8547 High Similarity NPC471920
0.8547 High Similarity NPC471922
0.8547 High Similarity NPC129930
0.8545 High Similarity NPC66029
0.8539 High Similarity NPC477081
0.8539 High Similarity NPC205721
0.8539 High Similarity NPC477083
0.8539 High Similarity NPC269046
0.8538 High Similarity NPC207574
0.8538 High Similarity NPC473096
0.8538 High Similarity NPC291795
0.8538 High Similarity NPC163130
0.8538 High Similarity NPC259905

  Similar Clinical/Approved Drugs

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules.

●  The left chart: Distribution of similarity level between NPC313304 and all drugs/candidates.
●  The right table: Most similar clinical/approved drugs (Tc>=0.56 or Top200).

Similarity Score Similarity Level Drug ID Developmental Stage
0.9212 High Similarity NPD5844 Phase 1
0.8623 High Similarity NPD6959 Discontinued
0.8606 High Similarity NPD4868 Clinical (unspecified phase)
0.8483 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.8462 Intermediate Similarity NPD6232 Discontinued
0.8404 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.8404 Intermediate Similarity NPD7783 Phase 2
0.84 Intermediate Similarity NPD8313 Approved
0.84 Intermediate Similarity NPD8312 Approved
0.8373 Intermediate Similarity NPD1465 Phase 2
0.8371 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.8354 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.8333 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.8314 Intermediate Similarity NPD7473 Discontinued
0.8263 Intermediate Similarity NPD7819 Suspended
0.8256 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8256 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8256 Intermediate Similarity NPD6166 Phase 2
0.8225 Intermediate Similarity NPD7075 Discontinued
0.8199 Intermediate Similarity NPD4628 Phase 3
0.8193 Intermediate Similarity NPD4380 Phase 2
0.8182 Intermediate Similarity NPD6559 Discontinued
0.815 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.8144 Intermediate Similarity NPD7411 Suspended
0.8133 Intermediate Similarity NPD3226 Approved
0.8118 Intermediate Similarity NPD3749 Approved
0.811 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.8056 Intermediate Similarity NPD8150 Discontinued
0.8047 Intermediate Similarity NPD8455 Phase 2
0.8047 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.8047 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8032 Intermediate Similarity NPD7435 Discontinued
0.8025 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.8023 Intermediate Similarity NPD5494 Approved
0.8012 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.8011 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD5402 Approved
0.7988 Intermediate Similarity NPD6801 Discontinued
0.7968 Intermediate Similarity NPD6779 Approved
0.7968 Intermediate Similarity NPD6777 Approved
0.7968 Intermediate Similarity NPD6782 Approved
0.7968 Intermediate Similarity NPD6776 Approved
0.7968 Intermediate Similarity NPD6780 Approved
0.7968 Intermediate Similarity NPD6778 Approved
0.7968 Intermediate Similarity NPD6781 Approved
0.7966 Intermediate Similarity NPD7074 Phase 3
0.7955 Intermediate Similarity NPD3751 Discontinued
0.7953 Intermediate Similarity NPD7768 Phase 2
0.7933 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7917 Intermediate Similarity NPD8151 Discontinued
0.791 Intermediate Similarity NPD7054 Approved
0.7892 Intermediate Similarity NPD2532 Approved
0.7892 Intermediate Similarity NPD2533 Approved
0.7892 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7892 Intermediate Similarity NPD2534 Approved
0.7882 Intermediate Similarity NPD1934 Approved
0.7866 Intermediate Similarity NPD3750 Approved
0.7866 Intermediate Similarity NPD7003 Approved
0.7865 Intermediate Similarity NPD7472 Approved
0.7853 Intermediate Similarity NPD7228 Approved
0.7842 Intermediate Similarity NPD7698 Approved
0.7842 Intermediate Similarity NPD7697 Approved
0.7842 Intermediate Similarity NPD7696 Phase 3
0.784 Intermediate Similarity NPD2935 Discontinued
0.7836 Intermediate Similarity NPD2801 Approved
0.7829 Intermediate Similarity NPD3787 Discontinued
0.7821 Intermediate Similarity NPD6797 Phase 2
0.7802 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7801 Intermediate Similarity NPD7870 Phase 2
0.7801 Intermediate Similarity NPD7871 Phase 2
0.7791 Intermediate Similarity NPD2346 Discontinued
0.7784 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD7874 Approved
0.7778 Intermediate Similarity NPD7251 Discontinued
0.7772 Intermediate Similarity NPD7701 Phase 2
0.7765 Intermediate Similarity NPD6599 Discontinued
0.7753 Intermediate Similarity NPD7177 Discontinued
0.7753 Intermediate Similarity NPD3818 Discontinued
0.7738 Intermediate Similarity NPD6273 Approved
0.7735 Intermediate Similarity NPD7808 Phase 3
0.7706 Intermediate Similarity NPD7458 Discontinued
0.7701 Intermediate Similarity NPD6534 Approved
0.7701 Intermediate Similarity NPD6535 Approved
0.7696 Intermediate Similarity NPD6823 Phase 2
0.7688 Intermediate Similarity NPD3817 Phase 2
0.7679 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7674 Intermediate Similarity NPD37 Approved
0.7672 Intermediate Similarity NPD7699 Phase 2
0.7672 Intermediate Similarity NPD7700 Phase 2
0.767 Intermediate Similarity NPD7199 Phase 2
0.7657 Intermediate Similarity NPD6234 Discontinued
0.7651 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7644 Intermediate Similarity NPD4967 Phase 2
0.7644 Intermediate Similarity NPD4966 Approved
0.7644 Intermediate Similarity NPD4965 Approved
0.7636 Intermediate Similarity NPD1549 Phase 2
0.7627 Intermediate Similarity NPD7229 Phase 3
0.7622 Intermediate Similarity NPD5404 Approved
0.7622 Intermediate Similarity NPD5408 Approved
0.7622 Intermediate Similarity NPD5405 Approved
0.7622 Intermediate Similarity NPD5406 Approved
0.7619 Intermediate Similarity NPD7390 Discontinued
0.7619 Intermediate Similarity NPD6799 Approved
0.7605 Intermediate Similarity NPD6190 Approved
0.7588 Intermediate Similarity NPD5403 Approved
0.7576 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7576 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7568 Intermediate Similarity NPD8434 Phase 2
0.7563 Intermediate Similarity NPD7801 Approved
0.7561 Intermediate Similarity NPD3748 Approved
0.7543 Intermediate Similarity NPD3882 Suspended
0.753 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7526 Intermediate Similarity NPD8320 Phase 1
0.7526 Intermediate Similarity NPD8319 Approved
0.7516 Intermediate Similarity NPD3764 Approved
0.7488 Intermediate Similarity NPD8155 Clinical (unspecified phase)
0.7486 Intermediate Similarity NPD7240 Approved
0.7486 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7486 Intermediate Similarity NPD7685 Pre-registration
0.7472 Intermediate Similarity NPD8127 Discontinued
0.7471 Intermediate Similarity NPD5401 Approved
0.7469 Intermediate Similarity NPD6233 Phase 2
0.746 Intermediate Similarity NPD6213 Phase 3
0.746 Intermediate Similarity NPD6214 Clinical (unspecified phase)
0.746 Intermediate Similarity NPD6212 Phase 3
0.7455 Intermediate Similarity NPD4308 Phase 3
0.7453 Intermediate Similarity NPD4625 Phase 3
0.7448 Intermediate Similarity NPD8285 Discontinued
0.7442 Intermediate Similarity NPD1653 Approved
0.743 Intermediate Similarity NPD5710 Approved
0.743 Intermediate Similarity NPD5711 Approved
0.7423 Intermediate Similarity NPD4060 Phase 1
0.7412 Intermediate Similarity NPD1511 Approved
0.741 Intermediate Similarity NPD6099 Approved
0.741 Intermediate Similarity NPD6100 Approved
0.741 Intermediate Similarity NPD1551 Phase 2
0.741 Intermediate Similarity NPD2438 Suspended
0.741 Intermediate Similarity NPD2796 Approved
0.7407 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7407 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.7407 Intermediate Similarity NPD6798 Discontinued
0.7384 Intermediate Similarity NPD920 Approved
0.7384 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7381 Intermediate Similarity NPD5698 Clinical (unspecified phase)
0.7378 Intermediate Similarity NPD5124 Phase 1
0.7378 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7368 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD1510 Phase 2
0.7349 Intermediate Similarity NPD2799 Discontinued
0.7344 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7333 Intermediate Similarity NPD1607 Approved
0.7326 Intermediate Similarity NPD1512 Approved
0.731 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7301 Intermediate Similarity NPD7985 Registered
0.7301 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7289 Intermediate Similarity NPD7097 Phase 1
0.7284 Intermediate Similarity NPD4908 Phase 1
0.7273 Intermediate Similarity NPD230 Phase 1
0.7267 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7263 Intermediate Similarity NPD919 Approved
0.7262 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7258 Intermediate Similarity NPD7549 Discontinued
0.725 Intermediate Similarity NPD1283 Approved
0.7246 Intermediate Similarity NPD7033 Discontinued
0.7243 Intermediate Similarity NPD5953 Discontinued
0.7236 Intermediate Similarity NPD7585 Approved
0.7216 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD1613 Approved
0.7212 Intermediate Similarity NPD4307 Phase 2
0.7212 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7212 Intermediate Similarity NPD2979 Phase 3
0.7212 Intermediate Similarity NPD1240 Approved
0.7211 Intermediate Similarity NPD4287 Approved
0.7205 Intermediate Similarity NPD2797 Approved
0.7204 Intermediate Similarity NPD7038 Approved
0.7204 Intermediate Similarity NPD7039 Approved
0.7195 Intermediate Similarity NPD2313 Discontinued
0.7195 Intermediate Similarity NPD3268 Approved
0.7186 Intermediate Similarity NPD7583 Approved
0.7182 Intermediate Similarity NPD1247 Approved
0.7178 Intermediate Similarity NPD6832 Phase 2
0.7176 Intermediate Similarity NPD6674 Discontinued
0.7176 Intermediate Similarity NPD1243 Approved
0.717 Intermediate Similarity NPD1611 Approved
0.7169 Intermediate Similarity NPD447 Suspended
0.7169 Intermediate Similarity NPD6355 Discontinued
0.716 Intermediate Similarity NPD7266 Discontinued
0.716 Intermediate Similarity NPD2344 Approved
0.7151 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD7211 Clinical (unspecified phase)
0.7135 Intermediate Similarity NPD5760 Phase 2
0.7135 Intermediate Similarity NPD7286 Phase 2
0.7135 Intermediate Similarity NPD5761 Phase 2
0.7125 Intermediate Similarity NPD1608 Approved
0.7121 Intermediate Similarity NPD7680 Approved
0.7118 Intermediate Similarity NPD2424 Discontinued
0.7117 Intermediate Similarity NPD2861 Phase 2
0.7104 Intermediate Similarity NPD3926 Phase 2

Structure

External Identifiers

PubChem CID   174343
ChEMBL   CHEMBL1736358
ZINC  

Physicochemical Properties

Molecular Weight:  496.17
ALogP:  -1.5437
MLogP:  3.44
XLogP:  2.403
# Rotatable Bonds:  12
Polar Surface Area:  134.91
# H-Bond Aceptor:  5
# H-Bond Donor:  4
# Rings:  5
# Heavy Atoms:  36

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Source Organisms  
Biological Activities  
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