Natural Product: NPC221085

Natural Product ID:  NPC221085
Common Name:   (3E)-5,6-Dihydroxy-3-(3-Hydroxy-5-Oxo-4-Tridecylfuran-2-Ylidene)-7-Tridecyl-1-Benzofuran-2-One
IUPAC Name:   (3E)-5,6-dihydroxy-3-(3-hydroxy-5-oxo-4-tridecylfuran-2-ylidene)-7-tridecyl-1-benzofuran-2-one
Synonyms:  
Molecular Formula:   C38H58O7
Standard InCHIKey:  CUKDXKLGQVRPBL-WIKZRCHHSA-N
Standard InCHI:  InChI=1S/C38H58O7/c1-3-5-7-9-11-13-15-17-19-21-23-25-28-33(40)31(39)27-30-32(38(43)44-35(28)30)36-34(41)29(37(42)45-36)26-24-22-20-18-16-14-12-10-8-6-4-2/h27,39-41H,3-26H2,1-2H3/b36-32+
Canonical SMILES:  CCCCCCCCCCCCCC1=C(O)/C(=C/2C(=O)Oc3c2cc(O)c(c3CCCCCCCCCCCCC)O)/OC1=O
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
NPO15741 Embelia ribes Species Primulaceae Eukaryota PMID[17125236]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT180 Cell Line HCT-8 Homo sapiens IC50 > 10 ug/ml 11170665
NPT179 Cell Line A2780 Homo sapiens IC50 > 10 ug/ml 20035557
NPT547 Cell Line BGC-823 Homo sapiens IC50 > 10 ug/ml 18161942
NPT81 Cell Line A549 Homo sapiens IC50 > 10 ug/ml 15974609
NPT181 Cell Line Bel-7402 Homo sapiens IC50 > 10 ug/ml 16562854

  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 NPC221085 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
0.9863 High Similarity NPC77430
0.8726 High Similarity NPC83763
0.8726 High Similarity NPC168616
0.859 High Similarity NPC476631
0.8562 High Similarity NPC8300
0.8526 High Similarity NPC249570
0.8526 High Similarity NPC289968
0.8519 High Similarity NPC471823
0.8519 High Similarity NPC472452
0.8509 High Similarity NPC234004
0.8506 High Similarity NPC107636
0.8481 Intermediate Similarity NPC138243
0.8481 Intermediate Similarity NPC68093
0.8481 Intermediate Similarity NPC472456
0.8481 Intermediate Similarity NPC191146
0.8476 Intermediate Similarity NPC218533
0.8476 Intermediate Similarity NPC78830
0.8457 Intermediate Similarity NPC85057
0.8457 Intermediate Similarity NPC130920
0.8447 Intermediate Similarity NPC81679
0.8442 Intermediate Similarity NPC139839
0.8438 Intermediate Similarity NPC320359
0.8431 Intermediate Similarity NPC287275
0.8431 Intermediate Similarity NPC262282
0.8428 Intermediate Similarity NPC78225
0.8428 Intermediate Similarity NPC36852
0.8428 Intermediate Similarity NPC236796
0.8428 Intermediate Similarity NPC262286
0.8425 Intermediate Similarity NPC474635
0.8418 Intermediate Similarity NPC113906
0.8418 Intermediate Similarity NPC79998
0.8408 Intermediate Similarity NPC199773
0.8395 Intermediate Similarity NPC474350
0.8389 Intermediate Similarity NPC105493
0.8385 Intermediate Similarity NPC40491
0.8385 Intermediate Similarity NPC278052
0.8378 Intermediate Similarity NPC252095
0.8375 Intermediate Similarity NPC100123
0.8375 Intermediate Similarity NPC238381
0.8373 Intermediate Similarity NPC37606
0.8373 Intermediate Similarity NPC233956
0.8373 Intermediate Similarity NPC261471
0.8367 Intermediate Similarity NPC277021
0.8367 Intermediate Similarity NPC474810
0.8366 Intermediate Similarity NPC213900
0.8365 Intermediate Similarity NPC54928
0.8365 Intermediate Similarity NPC317383
0.8365 Intermediate Similarity NPC150227
0.8365 Intermediate Similarity NPC142339
0.8364 Intermediate Similarity NPC281835
0.8364 Intermediate Similarity NPC180768
0.8364 Intermediate Similarity NPC17219
0.8364 Intermediate Similarity NPC124470
0.8364 Intermediate Similarity NPC109827
0.8356 Intermediate Similarity NPC142530
0.8356 Intermediate Similarity NPC147317
0.8354 Intermediate Similarity NPC475895
0.8344 Intermediate Similarity NPC326520
0.8344 Intermediate Similarity NPC8070
0.8333 Intermediate Similarity NPC144843
0.8333 Intermediate Similarity NPC207516
0.8323 Intermediate Similarity NPC14353
0.8323 Intermediate Similarity NPC204290
0.8323 Intermediate Similarity NPC200594
0.8323 Intermediate Similarity NPC30647
0.8323 Intermediate Similarity NPC228785
0.8323 Intermediate Similarity NPC119224
0.8323 Intermediate Similarity NPC55557
0.8323 Intermediate Similarity NPC56085
0.8323 Intermediate Similarity NPC61871
0.8323 Intermediate Similarity NPC251188
0.8323 Intermediate Similarity NPC292415
0.8323 Intermediate Similarity NPC476980
0.8323 Intermediate Similarity NPC246478
0.8322 Intermediate Similarity NPC326847
0.8313 Intermediate Similarity NPC77679
0.8313 Intermediate Similarity NPC84935
0.8313 Intermediate Similarity NPC158226
0.8313 Intermediate Similarity NPC79053
0.8313 Intermediate Similarity NPC476630
0.8313 Intermediate Similarity NPC218871
0.8313 Intermediate Similarity NPC223787
0.8313 Intermediate Similarity NPC190020
0.8303 Intermediate Similarity NPC165979
0.8303 Intermediate Similarity NPC163130
0.8302 Intermediate Similarity NPC199926
0.8302 Intermediate Similarity NPC18954
0.8302 Intermediate Similarity NPC471800
0.8301 Intermediate Similarity NPC134975
0.8293 Intermediate Similarity NPC170245
0.8291 Intermediate Similarity NPC471982
0.8289 Intermediate Similarity NPC469564
0.8289 Intermediate Similarity NPC472335
0.8289 Intermediate Similarity NPC472332
0.8282 Intermediate Similarity NPC473313
0.8282 Intermediate Similarity NPC236132
0.8282 Intermediate Similarity NPC284007
0.8282 Intermediate Similarity NPC7483
0.8282 Intermediate Similarity NPC472278
0.8282 Intermediate Similarity NPC156082
0.8282 Intermediate Similarity NPC329669
0.828 Intermediate Similarity NPC3825
0.828 Intermediate Similarity NPC88804
0.828 Intermediate Similarity NPC96501
0.828 Intermediate Similarity NPC179178
0.8274 Intermediate Similarity NPC164384
0.8272 Intermediate Similarity NPC266314
0.8272 Intermediate Similarity NPC103201
0.8272 Intermediate Similarity NPC349525
0.8272 Intermediate Similarity NPC473106
0.8272 Intermediate Similarity NPC258331
0.8272 Intermediate Similarity NPC475883
0.8272 Intermediate Similarity NPC259456
0.8272 Intermediate Similarity NPC474351
0.8272 Intermediate Similarity NPC61010
0.8272 Intermediate Similarity NPC167678
0.8272 Intermediate Similarity NPC29876
0.8272 Intermediate Similarity NPC303565
0.8267 Intermediate Similarity NPC112068
0.8267 Intermediate Similarity NPC95679
0.8267 Intermediate Similarity NPC25305
0.8267 Intermediate Similarity NPC125417
0.8267 Intermediate Similarity NPC110899
0.8261 Intermediate Similarity NPC195832
0.8261 Intermediate Similarity NPC45846
0.8261 Intermediate Similarity NPC185258
0.8261 Intermediate Similarity NPC172770
0.8261 Intermediate Similarity NPC196879
0.8261 Intermediate Similarity NPC267627
0.8261 Intermediate Similarity NPC250214
0.8261 Intermediate Similarity NPC40702
0.8261 Intermediate Similarity NPC469658
0.8261 Intermediate Similarity NPC37502
0.8261 Intermediate Similarity NPC87317
0.8261 Intermediate Similarity NPC95936
0.8258 Intermediate Similarity NPC165389
0.825 Intermediate Similarity NPC318432
0.825 Intermediate Similarity NPC291948
0.825 Intermediate Similarity NPC300845
0.825 Intermediate Similarity NPC276444
0.825 Intermediate Similarity NPC104983
0.825 Intermediate Similarity NPC274730
0.825 Intermediate Similarity NPC470328
0.825 Intermediate Similarity NPC209614
0.825 Intermediate Similarity NPC88803
0.825 Intermediate Similarity NPC472626
0.825 Intermediate Similarity NPC250436
0.8247 Intermediate Similarity NPC105213
0.8247 Intermediate Similarity NPC113397
0.8242 Intermediate Similarity NPC86477
0.8242 Intermediate Similarity NPC247973
0.8242 Intermediate Similarity NPC126204
0.8239 Intermediate Similarity NPC298692
0.8239 Intermediate Similarity NPC189130
0.8239 Intermediate Similarity NPC49402
0.8239 Intermediate Similarity NPC274327
0.8239 Intermediate Similarity NPC176775
0.8239 Intermediate Similarity NPC22519
0.8239 Intermediate Similarity NPC70433
0.8239 Intermediate Similarity NPC227337
0.8239 Intermediate Similarity NPC75279
0.8239 Intermediate Similarity NPC47781
0.8239 Intermediate Similarity NPC160951
0.8239 Intermediate Similarity NPC33051
0.8239 Intermediate Similarity NPC255350
0.8239 Intermediate Similarity NPC273462
0.8239 Intermediate Similarity NPC276409
0.8239 Intermediate Similarity NPC298802
0.8239 Intermediate Similarity NPC145379
0.8239 Intermediate Similarity NPC183878
0.8239 Intermediate Similarity NPC69394
0.8239 Intermediate Similarity NPC250822
0.8239 Intermediate Similarity NPC89474
0.8239 Intermediate Similarity NPC231018
0.8235 Intermediate Similarity NPC91492
0.8235 Intermediate Similarity NPC7439
0.8235 Intermediate Similarity NPC236419
0.8235 Intermediate Similarity NPC256555
0.8235 Intermediate Similarity NPC34245
0.8235 Intermediate Similarity NPC110067
0.8232 Intermediate Similarity NPC267153
0.8232 Intermediate Similarity NPC300053
0.8232 Intermediate Similarity NPC473286
0.8232 Intermediate Similarity NPC37183
0.8232 Intermediate Similarity NPC142614
0.8232 Intermediate Similarity NPC39306
0.8232 Intermediate Similarity NPC112981
0.8228 Intermediate Similarity NPC75695
0.8228 Intermediate Similarity NPC59162
0.8228 Intermediate Similarity NPC171010
0.8228 Intermediate Similarity NPC304295
0.8228 Intermediate Similarity NPC205046
0.8221 Intermediate Similarity NPC472448
0.8221 Intermediate Similarity NPC83922
0.8221 Intermediate Similarity NPC261470
0.8221 Intermediate Similarity NPC312056
0.8221 Intermediate Similarity NPC93739
0.8221 Intermediate Similarity NPC25152
0.8221 Intermediate Similarity NPC220912
0.8221 Intermediate Similarity NPC84515

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC221085 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
0.825 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.8239 Intermediate Similarity NPD2801 Approved
0.8125 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8125 Intermediate Similarity NPD1465 Phase 2
0.8025 Intermediate Similarity NPD3882 Suspended
0.8 Intermediate Similarity NPD230 Phase 1
0.7976 Intermediate Similarity NPD5844 Phase 1
0.7962 Intermediate Similarity NPD2533 Approved
0.7962 Intermediate Similarity NPD2532 Approved
0.7962 Intermediate Similarity NPD2534 Approved
0.795 Intermediate Similarity NPD1934 Approved
0.7898 Intermediate Similarity NPD1511 Approved
0.7818 Intermediate Similarity NPD6234 Discontinued
0.7811 Intermediate Similarity NPD3818 Discontinued
0.7799 Intermediate Similarity NPD1512 Approved
0.7785 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD6232 Discontinued
0.7778 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7771 Intermediate Similarity NPD5494 Approved
0.7758 Intermediate Similarity NPD7075 Discontinued
0.7756 Intermediate Similarity NPD2800 Approved
0.7751 Intermediate Similarity NPD7473 Discontinued
0.7744 Intermediate Similarity NPD3817 Phase 2
0.7707 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7688 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD7819 Suspended
0.7682 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7657 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7647 Intermediate Similarity NPD447 Suspended
0.7625 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7619 Intermediate Similarity NPD7199 Phase 2
0.7616 Intermediate Similarity NPD7074 Phase 3
0.7605 Intermediate Similarity NPD919 Approved
0.7602 Intermediate Similarity NPD7228 Approved
0.76 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7593 Intermediate Similarity NPD1653 Approved
0.759 Intermediate Similarity NPD4967 Phase 2
0.759 Intermediate Similarity NPD4966 Approved
0.759 Intermediate Similarity NPD4965 Approved
0.7588 Intermediate Similarity NPD6166 Phase 2
0.7588 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7588 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.758 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7564 Intermediate Similarity NPD2935 Discontinued
0.7558 Intermediate Similarity NPD7054 Approved
0.755 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7532 Intermediate Similarity NPD1243 Approved
0.7531 Intermediate Similarity NPD920 Approved
0.7529 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7515 Intermediate Similarity NPD1247 Approved
0.7515 Intermediate Similarity NPD37 Approved
0.7515 Intermediate Similarity NPD6801 Discontinued
0.7514 Intermediate Similarity NPD7472 Approved
0.75 Intermediate Similarity NPD9269 Phase 2
0.7453 Intermediate Similarity NPD6799 Approved
0.7432 Intermediate Similarity NPD422 Phase 1
0.7429 Intermediate Similarity NPD7251 Discontinued
0.7423 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7394 Intermediate Similarity NPD4380 Phase 2
0.7386 Intermediate Similarity NPD7808 Phase 3
0.7381 Intermediate Similarity NPD7768 Phase 2
0.7375 Intermediate Similarity NPD3750 Approved
0.7371 Intermediate Similarity NPD6797 Phase 2
0.7368 Intermediate Similarity NPD7229 Phase 3
0.7356 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7355 Intermediate Similarity NPD1613 Approved
0.7355 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7349 Intermediate Similarity NPD7411 Suspended
0.7342 Intermediate Similarity NPD6099 Approved
0.7342 Intermediate Similarity NPD6100 Approved
0.7338 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7337 Intermediate Similarity NPD3749 Approved
0.7333 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.733 Intermediate Similarity NPD6559 Discontinued
0.7329 Intermediate Similarity NPD6190 Approved
0.7321 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD5402 Approved
0.7312 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7301 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7301 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7289 Intermediate Similarity NPD6599 Discontinued
0.7273 Intermediate Similarity NPD3027 Phase 3
0.7267 Intermediate Similarity NPD5710 Approved
0.7267 Intermediate Similarity NPD5711 Approved
0.7267 Intermediate Similarity NPD4628 Phase 3
0.7244 Intermediate Similarity NPD943 Approved
0.7235 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD9268 Approved
0.7209 Intermediate Similarity NPD6959 Discontinued
0.7188 Intermediate Similarity NPD6005 Phase 3
0.7188 Intermediate Similarity NPD6002 Phase 3
0.7188 Intermediate Similarity NPD6006 Clinical (unspecified phase)
0.7188 Intermediate Similarity NPD6003 Clinical (unspecified phase)
0.7188 Intermediate Similarity NPD6004 Phase 3
0.7188 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7188 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7184 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7178 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7171 Intermediate Similarity NPD6696 Suspended
0.7159 Intermediate Similarity NPD7286 Phase 2
0.7152 Intermediate Similarity NPD1608 Approved
0.7152 Intermediate Similarity NPD6651 Approved
0.7143 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD9494 Approved
0.7143 Intermediate Similarity NPD1549 Phase 2
0.7135 Intermediate Similarity NPD7240 Approved
0.7134 Intermediate Similarity NPD1240 Approved
0.7126 Intermediate Similarity NPD3926 Phase 2
0.7126 Intermediate Similarity NPD3226 Approved
0.7124 Intermediate Similarity NPD2797 Approved
0.7118 Intermediate Similarity NPD5353 Approved
0.7115 Intermediate Similarity NPD3268 Approved
0.7115 Intermediate Similarity NPD1296 Phase 2
0.7111 Intermediate Similarity NPD7090 Clinical (unspecified phase)
0.711 Intermediate Similarity NPD8127 Discontinued
0.7089 Intermediate Similarity NPD6355 Discontinued
0.7089 Intermediate Similarity NPD5123 Clinical (unspecified phase)
0.7089 Intermediate Similarity NPD5124 Phase 1
0.7065 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD1510 Phase 2
0.7063 Intermediate Similarity NPD2799 Discontinued
0.7063 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7063 Intermediate Similarity NPD3748 Approved
0.7044 Intermediate Similarity NPD1607 Approved
0.7039 Intermediate Similarity NPD7685 Pre-registration
0.7039 Intermediate Similarity NPD9717 Approved
0.7033 Intermediate Similarity NPD8434 Phase 2
0.7025 Intermediate Similarity NPD4060 Phase 1
0.702 Intermediate Similarity NPD3496 Discontinued
0.7019 Intermediate Similarity NPD2796 Approved
0.7019 Intermediate Similarity NPD1551 Phase 2
0.7006 Intermediate Similarity NPD7985 Registered
0.6994 Remote Similarity NPD1652 Phase 2
0.6988 Remote Similarity NPD7004 Clinical (unspecified phase)
0.6983 Remote Similarity NPD5953 Discontinued
0.6962 Remote Similarity NPD6233 Phase 2
0.6959 Remote Similarity NPD8455 Phase 2
0.6954 Remote Similarity NPD17 Approved
0.6951 Remote Similarity NPD1878 Clinical (unspecified phase)
0.6948 Remote Similarity NPD3225 Approved
0.6933 Remote Similarity NPD2424 Discontinued
0.6932 Remote Similarity NPD5242 Approved
0.6928 Remote Similarity NPD1481 Phase 2
0.6905 Remote Similarity NPD5403 Approved
0.6903 Remote Similarity NPD1203 Approved
0.6899 Remote Similarity NPD411 Approved
0.6899 Remote Similarity NPD4907 Clinical (unspecified phase)
0.6899 Remote Similarity NPD2313 Discontinued
0.6899 Remote Similarity NPD6798 Discontinued
0.6883 Remote Similarity NPD4379 Clinical (unspecified phase)
0.6883 Remote Similarity NPD4749 Approved
0.6871 Remote Similarity NPD2344 Approved
0.6871 Remote Similarity NPD2346 Discontinued
0.6863 Remote Similarity NPD1535 Discovery
0.6852 Remote Similarity NPD4308 Phase 3
0.6852 Remote Similarity NPD7033 Discontinued
0.6848 Remote Similarity NPD4109 Clinical (unspecified phase)
0.6848 Remote Similarity NPD8166 Discontinued
0.6848 Remote Similarity NPD4110 Phase 3
0.6846 Remote Similarity NPD6671 Approved
0.6845 Remote Similarity NPD1940 Clinical (unspecified phase)
0.6842 Remote Similarity NPD6386 Approved
0.6842 Remote Similarity NPD6385 Approved
0.6842 Remote Similarity NPD1778 Approved
0.6842 Remote Similarity NPD7237 Clinical (unspecified phase)
0.6842 Remote Similarity NPD4626 Approved
0.6839 Remote Similarity NPD6971 Discontinued
0.6835 Remote Similarity NPD4625 Phase 3
0.6835 Remote Similarity NPD7095 Approved
0.6832 Remote Similarity NPD6653 Approved
0.6826 Remote Similarity NPD4357 Discontinued
0.6821 Remote Similarity NPD9545 Approved
0.6816 Remote Similarity NPD3751 Discontinued
0.6813 Remote Similarity NPD7549 Discontinued
0.6802 Remote Similarity NPD7782 Clinical (unspecified phase)
0.6802 Remote Similarity NPD7783 Phase 2
0.6798 Remote Similarity NPD2403 Approved
0.6795 Remote Similarity NPD3266 Approved
0.6795 Remote Similarity NPD3267 Approved
0.6792 Remote Similarity NPD3764 Approved
0.6792 Remote Similarity NPD6410 Clinical (unspecified phase)
0.6788 Remote Similarity NPD7680 Approved
0.6786 Remote Similarity NPD5401 Approved
0.6786 Remote Similarity NPD3688 Clinical (unspecified phase)
0.6786 Remote Similarity NPD3146 Approved
0.678 Remote Similarity NPD3787 Discontinued
0.6776 Remote Similarity NPD8313 Approved
0.6776 Remote Similarity NPD8312 Approved
0.6772 Remote Similarity NPD4908 Phase 1
0.6772 Remote Similarity NPD1008 Clinical (unspecified phase)
0.6772 Remote Similarity NPD6832 Phase 2
0.6768 Remote Similarity NPD2343 Clinical (unspecified phase)
0.6768 Remote Similarity NPD7266 Discontinued
0.6765 Remote Similarity NPD2370 Clinical (unspecified phase)
0.675 Remote Similarity NPD8032 Phase 2
0.6748 Remote Similarity NPD1509 Clinical (unspecified phase)
0.6747 Remote Similarity NPD7982 Clinical (unspecified phase)
0.6737 Remote Similarity NPD8090 Clinical (unspecified phase)
0.6725 Remote Similarity NPD7458 Discontinued

Structure

External Identifiers

PubChem CID   54678135
ChEMBL   CHEMBL447721
ZINC  

Physicochemical Properties

Molecular Weight:  626.42
ALogP:  -7.6769
MLogP:  4.87
XLogP:  14.463
# Rotatable Bonds:  29
Polar Surface Area:  113.29
# H-Bond Aceptor:  4
# H-Bond Donor:  3
# Rings:  3
# Heavy Atoms:  45

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Biological Activities  
Similar NPs/Drugs