Natural Product: NPC181523

Natural Product ID:  NPC181523
Common Name:   Fumarprotocetraric Acid
IUPAC Name:   4-[[(E)-3-carboxyprop-2-enoyl]oxymethyl]-10-formyl-3,9-dihydroxy-1,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-2-carboxylic acid
Synonyms:   NSC-685588
Molecular Formula:   C22H16O12
Standard InCHIKey:  VEGGRTFDFMUBPD-ONEGZZNKSA-N
Standard InCHI:  InChI=1S/C22H16O12/c1-8-5-12(24)10(6-23)19-15(8)22(31)34-20-11(7-32-14(27)4-3-13(25)26)17(28)16(21(29)30)9(2)18(20)33-19/h3-6,24,28H,7H2,1-2H3,(H,25,26)(H,29,30)/b4-3+
Canonical SMILES:  O=Cc1c(O)cc(c2c1Oc1c(OC2=O)c(COC(=O)/C=C/C(=O)O)c(c(c1C)C(=O)O)O)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
NPO2574 Usnea articulata Species Parmeliaceae Eukaryota PMID[17629329]

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 7300 nM 18954075
NPT197 Protein-Protein Interaction Menin/Histone-lysine N-methyltransferase MLL Homo sapiens Potency = 28183.8 nM 22850207
NPT533 Protein-Protein Interaction Runt-related transcription factor 1/Core-binding factor subunit beta Homo sapiens Potency 11220.2 nM 14738383
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 8912.5 nM 23713692
NPT533 Protein-Protein Interaction Runt-related transcription factor 1/Core-binding factor subunit beta Homo sapiens Potency 28183.8 nM 17158937
NPT151 Individual Protein 15-hydroxyprostaglandin dehydrogenase [NAD+] Homo sapiens Potency = 1412.5 nM 20733039
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens Potency = 39810.7 nM 20020916
NPT199 Individual Protein DNA polymerase kappa Homo sapiens Potency 3548.1 nM 17685651
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 4600 nM 15730245
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 Inhibition = 89.7 % 18672931
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 4900 nM 18672931
NPT24 Organism Human immunodeficiency virus 1 Human immunodeficiency virus 1 ED50 = 8.4 nM 17958396
NPT23 Individual Protein Integrase Human immunodeficiency virus 1 IC50 = 4900 nM 17958396
NPT23 Individual Protein Integrase Human immunodeficiency virus 1 IC50 = 4600 nM 17958396
NPT444 Individual Protein Ubiquitin carboxyl-terminal hydrolase 1 Homo sapiens Potency 56234.1 nM 15270579
NPT443 Individual Protein Histone acetyltransferase GCN5 Homo sapiens Potency 19952.6 nM 24467317
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 Inhibition = 94.4 % 10.6019/CHEMBL1201861
NPT94 Individual Protein Aldehyde dehydrogenase 1A1 Homo sapiens Potency = 4466.8 nM 7528786
NPT46 Individual Protein Thyroid hormone receptor beta-1 Homo sapiens Potency = 31622.8 nM 20441198
NPT51 Individual Protein Microtubule-associated protein tau Homo sapiens Potency = 3548.1 nM 23186727
NPT776 Organism Spodoptera littoralis Spodoptera littoralis ED50 = 30.5 nM 17420206
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency 1258.9 nM 18663019
NPT1119 Individual Protein Arachidonate 12-lipoxygenase Homo sapiens Potency = 15848.9 nM 26090896
NPT792 Individual Protein Arachidonate 15-lipoxygenase Homo sapiens Potency = 25118.9 nM 26151487
NPT50 Individual Protein Tyrosyl-DNA phosphodiesterase 1 Homo sapiens Potency 3162.3 nM 21377877
NPT47 Individual Protein ATP-dependent DNA helicase Q1 Homo sapiens Potency = 3981.1 nM 26034885
NPT48 Individual Protein Lysine-specific demethylase 4D-like Homo sapiens Potency = 28183.8 nM 26341134
NPT109 Individual Protein Cytochrome P450 3A4 Homo sapiens Potency = 39810.7 nM 20361799
NPT2 Others Unspecified Activity = 20 % 19734910
NPT55 Individual Protein Putative fructose-1,6-bisphosphate aldolase Giardia intestinalis Potency = 19905.4 nM 23621813
NPT197 Protein-Protein Interaction Menin/Histone-lysine N-methyltransferase MLL Homo sapiens Potency = 25118.9 nM 21256013
NPT50 Individual Protein Tyrosyl-DNA phosphodiesterase 1 Homo sapiens Potency = 39810.7 nM 25946116
NPT198 Individual Protein Vitamin D receptor Homo sapiens Potency 6309.6 nM 16472241
NPT46 Individual Protein Thyroid hormone receptor beta-1 Homo sapiens Potency = 7079.5 nM 18077425
NPT49 Individual Protein DNA-(apurinic or apyrimidinic site) lyase Homo sapiens Potency = 11220.2 nM 1825337
NPT2 Others Unspecified IC50 = 566000 nM PubChem BioAssay data set
NPT776 Organism Spodoptera littoralis Spodoptera littoralis Activity = 0.45 ug DrugMatrix in vitro pharmacology data
NPT45 Individual Protein Ubiquitin carboxyl-terminal hydrolase 2 Homo sapiens Potency = 25118.9 nM 21958738

  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 NPC181523 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
0.9876 High Similarity NPC10576
0.9876 High Similarity NPC246716
0.9814 High Similarity NPC26568
0.9753 High Similarity NPC239440
0.9753 High Similarity NPC20543
0.9753 High Similarity NPC1827
0.9752 High Similarity NPC292788
0.9752 High Similarity NPC272485
0.9695 High Similarity NPC139350
0.9576 High Similarity NPC289147
0.9568 High Similarity NPC20216
0.9565 High Similarity NPC156082
0.9521 High Similarity NPC113446
0.9512 High Similarity NPC17219
0.9506 High Similarity NPC112981
0.9405 High Similarity NPC470091
0.9405 High Similarity NPC329161
0.9405 High Similarity NPC240887
0.9394 High Similarity NPC109827
0.9394 High Similarity NPC124470
0.9379 High Similarity NPC143050
0.9333 High Similarity NPC49487
0.9333 High Similarity NPC99613
0.9325 High Similarity NPC300984
0.9273 High Similarity NPC234331
0.9268 High Similarity NPC267153
0.9264 High Similarity NPC93739
0.9222 High Similarity NPC158226
0.9212 High Similarity NPC29160
0.9207 High Similarity NPC474350
0.9207 High Similarity NPC284007
0.9202 High Similarity NPC303565
0.9152 High Similarity NPC8070
0.913 High Similarity NPC149618
0.913 High Similarity NPC89625
0.913 High Similarity NPC471800
0.9102 High Similarity NPC163130
0.9102 High Similarity NPC165979
0.908 High Similarity NPC168616
0.908 High Similarity NPC83763
0.908 High Similarity NPC238381
0.903 High Similarity NPC108767
0.8976 High Similarity NPC197168
0.8976 High Similarity NPC234004
0.897 High Similarity NPC66288
0.897 High Similarity NPC474187
0.8963 High Similarity NPC45846
0.8957 High Similarity NPC54928
0.8957 High Similarity NPC472456
0.8951 High Similarity NPC475895
0.8944 High Similarity NPC133856
0.8922 High Similarity NPC25361
0.8916 High Similarity NPC8300
0.8909 High Similarity NPC47623
0.8909 High Similarity NPC200594
0.8909 High Similarity NPC475886
0.8909 High Similarity NPC474287
0.8902 High Similarity NPC165977
0.8902 High Similarity NPC217677
0.8889 High Similarity NPC273483
0.8882 High Similarity NPC213382
0.8882 High Similarity NPC164527
0.8862 High Similarity NPC236132
0.8862 High Similarity NPC270837
0.8862 High Similarity NPC477689
0.8855 High Similarity NPC474186
0.8855 High Similarity NPC475883
0.8855 High Similarity NPC474351
0.8841 High Similarity NPC146211
0.882 High Similarity NPC106334
0.882 High Similarity NPC291049
0.882 High Similarity NPC233267
0.882 High Similarity NPC285527
0.881 High Similarity NPC130920
0.881 High Similarity NPC85057
0.8802 High Similarity NPC229632
0.8802 High Similarity NPC144843
0.8802 High Similarity NPC294965
0.8795 High Similarity NPC14353
0.8795 High Similarity NPC228785
0.8795 High Similarity NPC56085
0.8788 High Similarity NPC476981
0.8788 High Similarity NPC181960
0.8786 High Similarity NPC207467
0.8773 High Similarity NPC289968
0.8773 High Similarity NPC199773
0.8771 High Similarity NPC214901
0.8758 High Similarity NPC105415
0.8757 High Similarity NPC472452
0.8757 High Similarity NPC37870
0.875 High Similarity NPC101769
0.875 High Similarity NPC220313
0.875 High Similarity NPC7483
0.8743 High Similarity NPC258331
0.8743 High Similarity NPC266314
0.8743 High Similarity NPC311740
0.8743 High Similarity NPC40491
0.8743 High Similarity NPC61010
0.8743 High Similarity NPC278052
0.8736 High Similarity NPC473785
0.8735 High Similarity NPC100123
0.8721 High Similarity NPC233956
0.872 High Similarity NPC472915
0.872 High Similarity NPC280937
0.872 High Similarity NPC186507
0.8715 High Similarity NPC220369
0.8698 High Similarity NPC472450
0.8698 High Similarity NPC275780
0.8698 High Similarity NPC239752
0.8698 High Similarity NPC303174
0.8698 High Similarity NPC326520
0.869 High Similarity NPC470694
0.8683 High Similarity NPC299436
0.8683 High Similarity NPC119224
0.8683 High Similarity NPC320359
0.8683 High Similarity NPC292415
0.8683 High Similarity NPC476980
0.8683 High Similarity NPC36217
0.8683 High Similarity NPC84571
0.8675 High Similarity NPC241904
0.8675 High Similarity NPC108456
0.8675 High Similarity NPC44199
0.8675 High Similarity NPC300727
0.8675 High Similarity NPC263483
0.8675 High Similarity NPC36852
0.8675 High Similarity NPC78225
0.8675 High Similarity NPC262286
0.8671 High Similarity NPC245975
0.8667 High Similarity NPC472909
0.8667 High Similarity NPC31018
0.8667 High Similarity NPC38898
0.8667 High Similarity NPC37392
0.8667 High Similarity NPC255807
0.8663 High Similarity NPC475669
0.8663 High Similarity NPC260263
0.8659 High Similarity NPC175978
0.8655 High Similarity NPC476279
0.8647 High Similarity NPC170245
0.8647 High Similarity NPC30027
0.8647 High Similarity NPC272502
0.8647 High Similarity NPC39091
0.8647 High Similarity NPC43319
0.8642 High Similarity NPC5537
0.8639 High Similarity NPC23298
0.8639 High Similarity NPC41301
0.8639 High Similarity NPC152659
0.8639 High Similarity NPC207690
0.8639 High Similarity NPC248638
0.8639 High Similarity NPC236521
0.8639 High Similarity NPC189473
0.8634 High Similarity NPC163846
0.8634 High Similarity NPC225173
0.8631 High Similarity NPC349525
0.8631 High Similarity NPC473106
0.8631 High Similarity NPC32694
0.8631 High Similarity NPC103201
0.8623 High Similarity NPC476242
0.8623 High Similarity NPC477692
0.8623 High Similarity NPC95936
0.8623 High Similarity NPC250214
0.8623 High Similarity NPC85121
0.8621 High Similarity NPC107244
0.8614 High Similarity NPC191146
0.8614 High Similarity NPC474983
0.8614 High Similarity NPC68093
0.8614 High Similarity NPC138243
0.8614 High Similarity NPC142339
0.8614 High Similarity NPC197751
0.8614 High Similarity NPC274730
0.8614 High Similarity NPC472916
0.8614 High Similarity NPC227062
0.8606 High Similarity NPC135522
0.8606 High Similarity NPC477691
0.8606 High Similarity NPC298802
0.8605 High Similarity NPC281835
0.8605 High Similarity NPC241874
0.8603 High Similarity NPC295436
0.8598 High Similarity NPC474663
0.8598 High Similarity NPC208043
0.8598 High Similarity NPC226973
0.8598 High Similarity NPC204350
0.8598 High Similarity NPC198615
0.8598 High Similarity NPC117579
0.8598 High Similarity NPC262623
0.8598 High Similarity NPC149614
0.8598 High Similarity NPC308451
0.8596 High Similarity NPC218226
0.8596 High Similarity NPC477154
0.8596 High Similarity NPC474024
0.8596 High Similarity NPC117854
0.8596 High Similarity NPC247973
0.8596 High Similarity NPC76647
0.8596 High Similarity NPC6588
0.8588 High Similarity NPC50960
0.858 High Similarity NPC83922
0.858 High Similarity NPC119660
0.858 High Similarity NPC25152
0.858 High Similarity NPC472448
0.858 High Similarity NPC52204
0.858 High Similarity NPC265795

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC181523 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
0.8916 High Similarity NPD6232 Discontinued
0.8876 High Similarity NPD5844 Phase 1
0.8757 High Similarity NPD7473 Discontinued
0.8494 Intermediate Similarity NPD7819 Suspended
0.8494 Intermediate Similarity NPD2801 Approved
0.8383 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8353 Intermediate Similarity NPD5494 Approved
0.8344 Intermediate Similarity NPD2533 Approved
0.8344 Intermediate Similarity NPD2532 Approved
0.8344 Intermediate Similarity NPD2534 Approved
0.8333 Intermediate Similarity NPD3817 Phase 2
0.8323 Intermediate Similarity NPD1934 Approved
0.8284 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.8284 Intermediate Similarity NPD3882 Suspended
0.8274 Intermediate Similarity NPD1465 Phase 2
0.8253 Intermediate Similarity NPD3226 Approved
0.8235 Intermediate Similarity NPD7075 Discontinued
0.8198 Intermediate Similarity NPD1247 Approved
0.8187 Intermediate Similarity NPD919 Approved
0.8177 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.8171 Intermediate Similarity NPD3818 Discontinued
0.8155 Intermediate Similarity NPD7411 Suspended
0.8146 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.8095 Intermediate Similarity NPD6599 Discontinued
0.8092 Intermediate Similarity NPD6959 Discontinued
0.809 Intermediate Similarity NPD6559 Discontinued
0.8075 Intermediate Similarity NPD2935 Discontinued
0.8075 Intermediate Similarity NPD1551 Phase 2
0.8059 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.8057 Intermediate Similarity NPD6166 Phase 2
0.8057 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.8057 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.8012 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.8 Intermediate Similarity NPD6801 Discontinued
0.7988 Intermediate Similarity NPD4380 Phase 2
0.7978 Intermediate Similarity NPD7074 Phase 3
0.7975 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.7955 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7952 Intermediate Similarity NPD1511 Approved
0.7952 Intermediate Similarity NPD6799 Approved
0.7921 Intermediate Similarity NPD7054 Approved
0.7917 Intermediate Similarity NPD920 Approved
0.7907 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7907 Intermediate Similarity NPD5402 Approved
0.7892 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7877 Intermediate Similarity NPD7472 Approved
0.7861 Intermediate Similarity NPD7768 Phase 2
0.7857 Intermediate Similarity NPD1512 Approved
0.7833 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7826 Intermediate Similarity NPD447 Suspended
0.7816 Intermediate Similarity NPD3749 Approved
0.7816 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7805 Intermediate Similarity NPD2346 Discontinued
0.7798 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7798 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7791 Intermediate Similarity NPD2799 Discontinued
0.7791 Intermediate Similarity NPD37 Approved
0.7778 Intermediate Similarity NPD1607 Approved
0.7771 Intermediate Similarity NPD4628 Phase 3
0.7771 Intermediate Similarity NPD6234 Discontinued
0.7771 Intermediate Similarity NPD3750 Approved
0.7759 Intermediate Similarity NPD4967 Phase 2
0.7759 Intermediate Similarity NPD4966 Approved
0.7759 Intermediate Similarity NPD4965 Approved
0.7758 Intermediate Similarity NPD1549 Phase 2
0.7747 Intermediate Similarity NPD7808 Phase 3
0.774 Intermediate Similarity NPD5711 Approved
0.774 Intermediate Similarity NPD5710 Approved
0.7735 Intermediate Similarity NPD6797 Phase 2
0.7711 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.7697 Intermediate Similarity NPD3926 Phase 2
0.7697 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7697 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7696 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.7692 Intermediate Similarity NPD7251 Discontinued
0.7684 Intermediate Similarity NPD7199 Phase 2
0.7683 Intermediate Similarity NPD1510 Phase 2
0.7679 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7676 Intermediate Similarity NPD8434 Phase 2
0.7654 Intermediate Similarity NPD1240 Approved
0.7637 Intermediate Similarity NPD5953 Discontinued
0.7636 Intermediate Similarity NPD2796 Approved
0.7624 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.7622 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7609 Intermediate Similarity NPD8312 Approved
0.7609 Intermediate Similarity NPD8313 Approved
0.7607 Intermediate Similarity NPD230 Phase 1
0.7602 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7598 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7576 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7531 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7527 Intermediate Similarity NPD7286 Phase 2
0.75 Intermediate Similarity NPD2800 Approved
0.75 Intermediate Similarity NPD5403 Approved
0.75 Intermediate Similarity NPD1243 Approved
0.7487 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7487 Intermediate Similarity NPD7783 Phase 2
0.7487 Intermediate Similarity NPD7435 Discontinued
0.7487 Intermediate Similarity NPD8150 Discontinued
0.7485 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7473 Intermediate Similarity NPD7228 Approved
0.747 Intermediate Similarity NPD3748 Approved
0.7457 Intermediate Similarity NPD1653 Approved
0.7456 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7456 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.7439 Intermediate Similarity NPD943 Approved
0.7427 Intermediate Similarity NPD7390 Discontinued
0.7423 Intermediate Similarity NPD6777 Approved
0.7423 Intermediate Similarity NPD6779 Approved
0.7423 Intermediate Similarity NPD6776 Approved
0.7423 Intermediate Similarity NPD6778 Approved
0.7423 Intermediate Similarity NPD6781 Approved
0.7423 Intermediate Similarity NPD6780 Approved
0.7423 Intermediate Similarity NPD6782 Approved
0.7414 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7407 Intermediate Similarity NPD6832 Phase 2
0.7403 Intermediate Similarity NPD5242 Approved
0.7387 Intermediate Similarity NPD8151 Discontinued
0.7384 Intermediate Similarity NPD5401 Approved
0.7365 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7348 Intermediate Similarity NPD7229 Phase 3
0.7329 Intermediate Similarity NPD1203 Approved
0.7326 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7321 Intermediate Similarity NPD5408 Approved
0.7321 Intermediate Similarity NPD5406 Approved
0.7321 Intermediate Similarity NPD5405 Approved
0.7321 Intermediate Similarity NPD5404 Approved
0.7317 Intermediate Similarity NPD2313 Discontinued
0.7317 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.731 Intermediate Similarity NPD7697 Approved
0.731 Intermediate Similarity NPD7696 Phase 3
0.731 Intermediate Similarity NPD7698 Approved
0.731 Intermediate Similarity NPD6190 Approved
0.7293 Intermediate Similarity NPD8127 Discontinued
0.7289 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7289 Intermediate Similarity NPD1933 Approved
0.7283 Intermediate Similarity NPD3751 Discontinued
0.7273 Intermediate Similarity NPD7871 Phase 2
0.7273 Intermediate Similarity NPD7870 Phase 2
0.7264 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.7264 Intermediate Similarity NPD7874 Approved
0.7239 Intermediate Similarity NPD9494 Approved
0.7229 Intermediate Similarity NPD4060 Phase 1
0.7219 Intermediate Similarity NPD6099 Approved
0.7219 Intermediate Similarity NPD6100 Approved
0.7216 Intermediate Similarity NPD7458 Discontinued
0.7212 Intermediate Similarity NPD411 Approved
0.7189 Intermediate Similarity NPD7177 Discontinued
0.7184 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7176 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.7176 Intermediate Similarity NPD2344 Approved
0.7172 Intermediate Similarity NPD6823 Phase 2
0.7165 Intermediate Similarity NPD6534 Approved
0.7165 Intermediate Similarity NPD6535 Approved
0.7164 Intermediate Similarity NPD7701 Phase 2
0.716 Intermediate Similarity NPD4308 Phase 3
0.7158 Intermediate Similarity NPD3787 Discontinued
0.7152 Intermediate Similarity NPD4625 Phase 3
0.7152 Intermediate Similarity NPD3027 Phase 3
0.7151 Intermediate Similarity NPD7003 Approved
0.7143 Intermediate Similarity NPD6273 Approved
0.7143 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD9717 Approved
0.7143 Intermediate Similarity NPD6651 Approved
0.7135 Intermediate Similarity NPD6386 Approved
0.7135 Intermediate Similarity NPD6385 Approved
0.7128 Intermediate Similarity NPD7685 Pre-registration
0.7128 Intermediate Similarity NPD7240 Approved
0.7126 Intermediate Similarity NPD1613 Approved
0.7126 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7118 Intermediate Similarity NPD4476 Approved
0.7118 Intermediate Similarity NPD4477 Approved
0.7118 Intermediate Similarity NPD2438 Suspended
0.7111 Intermediate Similarity NPD5353 Approved
0.7108 Intermediate Similarity NPD3268 Approved
0.7107 Intermediate Similarity NPD8285 Discontinued
0.7097 Intermediate Similarity NPD7893 Clinical (unspecified phase)
0.7092 Intermediate Similarity NPD8090 Clinical (unspecified phase)
0.7091 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.709 Intermediate Similarity NPD7549 Discontinued
0.709 Intermediate Similarity NPD4419 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD7801 Approved
0.7056 Intermediate Similarity NPD7700 Phase 2
0.7056 Intermediate Similarity NPD7699 Phase 2
0.7055 Intermediate Similarity NPD1283 Approved
0.7039 Intermediate Similarity NPD7615 Clinical (unspecified phase)
0.7037 Intermediate Similarity NPD7038 Approved
0.7037 Intermediate Similarity NPD7039 Approved
0.7037 Intermediate Similarity NPD1608 Approved
0.703 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7024 Intermediate Similarity NPD2979 Phase 3
0.7017 Intermediate Similarity NPD4288 Approved
0.7012 Intermediate Similarity NPD2797 Approved
0.7011 Intermediate Similarity NPD2309 Approved
0.7006 Intermediate Similarity NPD3764 Approved
0.7006 Intermediate Similarity NPD4907 Clinical (unspecified phase)
0.6995 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6977 Remote Similarity NPD1471 Phase 3
0.6975 Remote Similarity NPD1611 Approved
0.6975 Remote Similarity NPD422 Phase 1

Structure

External Identifiers

PubChem CID   5317419
ChEMBL   CHEMBL366861
ZINC  

Physicochemical Properties

Molecular Weight:  472.06
ALogP:  -0.3789
MLogP:  2.56
XLogP:  1.971
# Rotatable Bonds:  13
Polar Surface Area:  193.96
# H-Bond Aceptor:  8
# H-Bond Donor:  4
# Rings:  3
# Heavy Atoms:  34

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Similar NPs/Drugs