Natural Product: NPC10576

Natural Product ID:  NPC10576
Common Name:   Psoromic Acid
IUPAC Name:   10-formyl-9-hydroxy-3-methoxy-4,7-dimethyl-6-oxobenzo[b][1,4]benzodioxepine-1-carboxylic acid
Synonyms:   NSC-92186
Molecular Formula:   C18H14O8
Standard InCHIKey:  FUCWJKJZOHOLEO-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C18H14O8/c1-7-4-11(20)10(6-19)15-13(7)18(23)26-14-8(2)12(24-3)5-9(17(21)22)16(14)25-15/h4-6,20H,1-3H3,(H,21,22)
Canonical SMILES:  COc1cc(C(=O)O)c2c(c1C)OC(=O)c1c(O2)c(C=O)c(cc1C)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
NPO24628.1 Lamium galeobdolon subsp. montanum Subspecies Lamiaceae Eukaryota UNPD*
NPO9944 Salisaeta longa Species Rhodothermaceae Bacteria UNPD*
NPO15622 Calea nelsonii Species Asteraceae Eukaryota UNPD*
NPO9262 Chamaecyparis hodginsii Species Cupressaceae Eukaryota UNPD*
NPO5348 Colletotrichum acutatum Species Glomerellaceae Eukaryota UNPD*
NPO9241 Adiantum capillus-veneris Species Pteridaceae Eukaryota UNPD*
NPO1157 Lichen usnea NA NA NA UNPD*
NPO25007 Cladonia stellaris Species Cladoniaceae Eukaryota TCMID*
NPO2602 Usnea longissima Species Parmeliaceae Eukaryota TCMID*
NPO5626 Ormosia henryi Species Fabaceae Eukaryota UNPD*
NPO12319 Xanthogaleruca luteola Species Chrysomelidae Eukaryota UNPD*
NPO6338 Chilo auricilius Species Crambidae Eukaryota UNPD*
NPO5515 Cephalocroton cordofanus Species Euphorbiaceae Eukaryota UNPD*
NPO12523 Dendrobium moniliforme Species Orchidaceae Eukaryota UNPD*
NPO12043 Eria coronaria Species Orchidaceae Eukaryota UNPD*
NPO20801 Antrodia sinuosa Species Fomitopsidaceae Eukaryota UNPD*
NPO8706 Aesculus pavia Species Sapindaceae Eukaryota UNPD*

  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 Inhibition = 98.9 % 9083483
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 Inhibition = 88.9 % 9083483
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 17000 nM 9083483
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 15100 nM 9083483
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 5300 nM 9083483
NPT12 Individual Protein Human immunodeficiency virus type 1 integrase Human immunodeficiency virus 1 IC50 = 12300 nM 9083483
NPT198 Individual Protein Vitamin D receptor Homo sapiens Potency 79432.8 nM PubChem BioAssay data set
NPT100 Individual Protein Glutaminase kidney isoform, mitochondrial Homo sapiens Potency 5623.4 nM PubChem BioAssay data set
NPT776 Organism Spodoptera littoralis Spodoptera littoralis Activity = 0.41 ug 10.1016/0305-1978(94)90001-9
NPT776 Organism Spodoptera littoralis Spodoptera littoralis ED50 = 46.2 nM 10.1016/0305-1978(94)90001-9
NPT160 Individual Protein TAR DNA-binding protein 43 Homo sapiens Potency 11220.2 nM PubChem BioAssay data set
NPT617 Organism Danio rerio Danio rerio Activity >= 40 % 23806111
NPT91 Cell Line KB Homo sapiens IC50 = 31600 nM 23806111
NPT2 Others Unspecified IC50 > 100000 nM 23806111
NPT1140 Organism Escherichia coli ATCC 8739 Escherichia coli ATCC 8739 IC50 > 64000 nM 23806111
NPT88 Organism Mycobacterium tuberculosis Mycobacterium tuberculosis MIC = 122900 nM 23806111
NPT2 Others Unspecified IC50 > 200000 nM 23806111
NPT2 Others Unspecified IC50 = 35200 nM 23806111
NPT2 Others Unspecified IC50 = 183000 nM 23806111
NPT2 Others Unspecified IC50 = 71400 nM 23806111
NPT485 Organism Plasmodium falciparum (isolate K1 / Thailand) Plasmodium falciparum K1 IC50 = 29200 nM 23806111
NPT474 Organism Plasmodium berghei Plasmodium berghei IC50 = 31600 nM 23806111
NPT535 Individual Protein Parathyroid hormone receptor Homo sapiens Potency 50118.7 nM PubChem BioAssay data set
NPT2 Others Unspecified Potency 1122 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 NPC10576 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
0.9937 High Similarity NPC26568
0.9876 High Similarity NPC181523
0.9875 High Similarity NPC246716
0.9875 High Similarity NPC1827
0.9752 High Similarity NPC20543
0.9752 High Similarity NPC239440
0.975 High Similarity NPC292788
0.975 High Similarity NPC272485
0.9693 High Similarity NPC139350
0.9573 High Similarity NPC289147
0.9565 High Similarity NPC20216
0.9563 High Similarity NPC156082
0.9518 High Similarity NPC470091
0.9518 High Similarity NPC240887
0.9518 High Similarity NPC329161
0.9518 High Similarity NPC113446
0.9509 High Similarity NPC17219
0.9503 High Similarity NPC112981
0.939 High Similarity NPC109827
0.939 High Similarity NPC124470
0.9375 High Similarity NPC143050
0.9329 High Similarity NPC49487
0.9329 High Similarity NPC99613
0.9325 High Similarity NPC29160
0.9321 High Similarity NPC300984
0.9268 High Similarity NPC234331
0.9264 High Similarity NPC267153
0.9259 High Similarity NPC93739
0.9217 High Similarity NPC158226
0.9212 High Similarity NPC163130
0.9212 High Similarity NPC165979
0.9202 High Similarity NPC474350
0.9202 High Similarity NPC284007
0.9198 High Similarity NPC303565
0.9146 High Similarity NPC8070
0.9125 High Similarity NPC149618
0.9125 High Similarity NPC89625
0.9125 High Similarity NPC471800
0.9074 High Similarity NPC168616
0.9074 High Similarity NPC83763
0.9074 High Similarity NPC238381
0.9024 High Similarity NPC108767
0.9018 High Similarity NPC200594
0.897 High Similarity NPC197168
0.8963 High Similarity NPC66288
0.8957 High Similarity NPC45846
0.8951 High Similarity NPC54928
0.8938 High Similarity NPC133856
0.8916 High Similarity NPC25361
0.8909 High Similarity NPC294965
0.8902 High Similarity NPC47623
0.8902 High Similarity NPC475886
0.8902 High Similarity NPC474287
0.8896 High Similarity NPC217677
0.8896 High Similarity NPC165977
0.8882 High Similarity NPC273483
0.8875 High Similarity NPC164527
0.8875 High Similarity NPC213382
0.8855 High Similarity NPC236132
0.8855 High Similarity NPC234004
0.8855 High Similarity NPC270837
0.8848 High Similarity NPC474186
0.8848 High Similarity NPC474351
0.8848 High Similarity NPC474187
0.8848 High Similarity NPC475883
0.8834 High Similarity NPC146211
0.8834 High Similarity NPC472456
0.8827 High Similarity NPC475895
0.8814 High Similarity NPC220369
0.8812 High Similarity NPC291049
0.8812 High Similarity NPC285527
0.8812 High Similarity NPC233267
0.8812 High Similarity NPC106334
0.8795 High Similarity NPC8300
0.8795 High Similarity NPC144843
0.8788 High Similarity NPC84571
0.8788 High Similarity NPC14353
0.8788 High Similarity NPC56085
0.8788 High Similarity NPC228785
0.8779 High Similarity NPC207467
0.8772 High Similarity NPC245975
0.8765 High Similarity NPC289968
0.8765 High Similarity NPC175978
0.8764 High Similarity NPC214901
0.875 High Similarity NPC105415
0.875 High Similarity NPC472452
0.8743 High Similarity NPC477689
0.8743 High Similarity NPC101769
0.8743 High Similarity NPC7483
0.8735 High Similarity NPC61010
0.8735 High Similarity NPC311740
0.8735 High Similarity NPC40491
0.8735 High Similarity NPC278052
0.8728 High Similarity NPC473785
0.8727 High Similarity NPC100123
0.8713 High Similarity NPC233956
0.8712 High Similarity NPC280937
0.8704 High Similarity NPC204350
0.869 High Similarity NPC326520
0.869 High Similarity NPC85057
0.869 High Similarity NPC130920
0.8683 High Similarity NPC470694
0.8683 High Similarity NPC229632
0.8675 High Similarity NPC320359
0.8675 High Similarity NPC119224
0.8667 High Similarity NPC181960
0.8667 High Similarity NPC262286
0.8667 High Similarity NPC241904
0.8667 High Similarity NPC36852
0.8667 High Similarity NPC300727
0.8667 High Similarity NPC476981
0.8667 High Similarity NPC263483
0.8659 High Similarity NPC20541
0.8659 High Similarity NPC38898
0.8655 High Similarity NPC260263
0.865 High Similarity NPC199773
0.8642 High Similarity NPC179183
0.8642 High Similarity NPC119929
0.8639 High Similarity NPC170245
0.8639 High Similarity NPC30027
0.8639 High Similarity NPC37870
0.8634 High Similarity NPC5537
0.8631 High Similarity NPC248638
0.8631 High Similarity NPC41301
0.8631 High Similarity NPC152659
0.8631 High Similarity NPC236521
0.8631 High Similarity NPC220313
0.8623 High Similarity NPC258331
0.8623 High Similarity NPC266314
0.8614 High Similarity NPC85121
0.8614 High Similarity NPC37502
0.8614 High Similarity NPC267627
0.8614 High Similarity NPC476242
0.8614 High Similarity NPC40702
0.8606 High Similarity NPC5379
0.8606 High Similarity NPC14561
0.8606 High Similarity NPC197751
0.8606 High Similarity NPC77807
0.8606 High Similarity NPC274730
0.8606 High Similarity NPC227062
0.8606 High Similarity NPC138243
0.8606 High Similarity NPC142339
0.8605 High Similarity NPC277510
0.8598 High Similarity NPC186507
0.8598 High Similarity NPC472915
0.8596 High Similarity NPC281835
0.8596 High Similarity NPC295436
0.8589 High Similarity NPC117579
0.8589 High Similarity NPC149614
0.8589 High Similarity NPC474663
0.8588 High Similarity NPC76647
0.8588 High Similarity NPC6588
0.8588 High Similarity NPC117854
0.8588 High Similarity NPC477154
0.8588 High Similarity NPC474024
0.858 High Similarity NPC239752
0.858 High Similarity NPC472450
0.858 High Similarity NPC303174
0.858 High Similarity NPC275780
0.8571 High Similarity NPC25152
0.8571 High Similarity NPC81679
0.8571 High Similarity NPC265795
0.8571 High Similarity NPC52204
0.8571 High Similarity NPC154720
0.8564 High Similarity NPC198163
0.8563 High Similarity NPC243701
0.8563 High Similarity NPC130955
0.8563 High Similarity NPC292415
0.8563 High Similarity NPC36217
0.8563 High Similarity NPC476980
0.8563 High Similarity NPC299436
0.8562 High Similarity NPC134621
0.8555 High Similarity NPC199533
0.8555 High Similarity NPC470454
0.8554 High Similarity NPC199463
0.8554 High Similarity NPC210084
0.8554 High Similarity NPC223787
0.8554 High Similarity NPC236796
0.8554 High Similarity NPC108456
0.8554 High Similarity NPC178976
0.8554 High Similarity NPC78103
0.8554 High Similarity NPC78225
0.8554 High Similarity NPC247713
0.8554 High Similarity NPC469584
0.8554 High Similarity NPC99597
0.8554 High Similarity NPC37543
0.8554 High Similarity NPC44199
0.8547 High Similarity NPC475669
0.8545 High Similarity NPC82592
0.8545 High Similarity NPC16082
0.8545 High Similarity NPC2928
0.8545 High Similarity NPC255807
0.8545 High Similarity NPC31018
0.8545 High Similarity NPC208197
0.8545 High Similarity NPC134287
0.8545 High Similarity NPC472909
0.8545 High Similarity NPC113906
0.8545 High Similarity NPC16286
0.8545 High Similarity NPC39184
0.8545 High Similarity NPC130589

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC10576 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
0.8795 High Similarity NPD6232 Discontinued
0.8757 High Similarity NPD5844 Phase 1
0.8639 High Similarity NPD7473 Discontinued
0.8373 Intermediate Similarity NPD2801 Approved
0.8373 Intermediate Similarity NPD1465 Phase 2
0.8373 Intermediate Similarity NPD7819 Suspended
0.8333 Intermediate Similarity NPD2532 Approved
0.8333 Intermediate Similarity NPD2533 Approved
0.8333 Intermediate Similarity NPD2534 Approved
0.8313 Intermediate Similarity NPD1934 Approved
0.8274 Intermediate Similarity NPD4868 Clinical (unspecified phase)
0.8263 Intermediate Similarity NPD2393 Clinical (unspecified phase)
0.8242 Intermediate Similarity NPD3226 Approved
0.8235 Intermediate Similarity NPD5494 Approved
0.8214 Intermediate Similarity NPD3817 Phase 2
0.8187 Intermediate Similarity NPD1247 Approved
0.8176 Intermediate Similarity NPD919 Approved
0.8166 Intermediate Similarity NPD3882 Suspended
0.8118 Intermediate Similarity NPD7075 Discontinued
0.8081 Intermediate Similarity NPD6959 Discontinued
0.8075 Intermediate Similarity NPD970 Clinical (unspecified phase)
0.8066 Intermediate Similarity NPD8397 Clinical (unspecified phase)
0.8063 Intermediate Similarity NPD1551 Phase 2
0.8057 Intermediate Similarity NPD3818 Discontinued
0.8036 Intermediate Similarity NPD7411 Suspended
0.8034 Intermediate Similarity NPD4338 Clinical (unspecified phase)
0.7978 Intermediate Similarity NPD6559 Discontinued
0.7976 Intermediate Similarity NPD6599 Discontinued
0.795 Intermediate Similarity NPD2935 Discontinued
0.7943 Intermediate Similarity NPD6168 Clinical (unspecified phase)
0.7943 Intermediate Similarity NPD6167 Clinical (unspecified phase)
0.7943 Intermediate Similarity NPD6166 Phase 2
0.7941 Intermediate Similarity NPD7096 Clinical (unspecified phase)
0.7939 Intermediate Similarity NPD1511 Approved
0.7904 Intermediate Similarity NPD920 Approved
0.7892 Intermediate Similarity NPD4378 Clinical (unspecified phase)
0.7882 Intermediate Similarity NPD6801 Discontinued
0.787 Intermediate Similarity NPD4380 Phase 2
0.7865 Intermediate Similarity NPD7074 Phase 3
0.7844 Intermediate Similarity NPD1512 Approved
0.7841 Intermediate Similarity NPD7852 Clinical (unspecified phase)
0.7831 Intermediate Similarity NPD6799 Approved
0.7821 Intermediate Similarity NPD7993 Clinical (unspecified phase)
0.7812 Intermediate Similarity NPD447 Suspended
0.7809 Intermediate Similarity NPD7054 Approved
0.7803 Intermediate Similarity NPD3749 Approved
0.7791 Intermediate Similarity NPD5402 Approved
0.7791 Intermediate Similarity NPD2346 Discontinued
0.7791 Intermediate Similarity NPD8443 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD7879 Clinical (unspecified phase)
0.7784 Intermediate Similarity NPD642 Clinical (unspecified phase)
0.7778 Intermediate Similarity NPD37 Approved
0.7765 Intermediate Similarity NPD7472 Approved
0.7764 Intermediate Similarity NPD1607 Approved
0.7759 Intermediate Similarity NPD6234 Discontinued
0.7758 Intermediate Similarity NPD3750 Approved
0.7746 Intermediate Similarity NPD7768 Phase 2
0.7746 Intermediate Similarity NPD4966 Approved
0.7746 Intermediate Similarity NPD4967 Phase 2
0.7746 Intermediate Similarity NPD4965 Approved
0.7744 Intermediate Similarity NPD1549 Phase 2
0.7727 Intermediate Similarity NPD5710 Approved
0.7727 Intermediate Similarity NPD5711 Approved
0.7702 Intermediate Similarity NPD230 Phase 1
0.7701 Intermediate Similarity NPD4381 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD1552 Clinical (unspecified phase)
0.7683 Intermediate Similarity NPD1550 Clinical (unspecified phase)
0.7679 Intermediate Similarity NPD7410 Clinical (unspecified phase)
0.7669 Intermediate Similarity NPD2799 Discontinued
0.7669 Intermediate Similarity NPD1510 Phase 2
0.7669 Intermediate Similarity NPD1509 Clinical (unspecified phase)
0.7665 Intermediate Similarity NPD643 Clinical (unspecified phase)
0.7651 Intermediate Similarity NPD4628 Phase 3
0.764 Intermediate Similarity NPD1240 Approved
0.7637 Intermediate Similarity NPD7808 Phase 3
0.7624 Intermediate Similarity NPD6797 Phase 2
0.7592 Intermediate Similarity NPD7501 Clinical (unspecified phase)
0.759 Intermediate Similarity NPD1243 Approved
0.759 Intermediate Similarity NPD7421 Clinical (unspecified phase)
0.759 Intermediate Similarity NPD2800 Approved
0.7584 Intermediate Similarity NPD3926 Phase 2
0.7582 Intermediate Similarity NPD7251 Discontinued
0.7571 Intermediate Similarity NPD7199 Phase 2
0.7568 Intermediate Similarity NPD8434 Phase 2
0.7527 Intermediate Similarity NPD5953 Discontinued
0.7515 Intermediate Similarity NPD2796 Approved
0.7514 Intermediate Similarity NPD8055 Clinical (unspecified phase)
0.7514 Intermediate Similarity NPD7804 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD8312 Approved
0.75 Intermediate Similarity NPD8313 Approved
0.7486 Intermediate Similarity NPD7184 Clinical (unspecified phase)
0.7485 Intermediate Similarity NPD6980 Clinical (unspecified phase)
0.7471 Intermediate Similarity NPD7422 Clinical (unspecified phase)
0.7459 Intermediate Similarity NPD7228 Approved
0.7455 Intermediate Similarity NPD3748 Approved
0.744 Intermediate Similarity NPD6398 Clinical (unspecified phase)
0.744 Intermediate Similarity NPD1878 Clinical (unspecified phase)
0.7423 Intermediate Similarity NPD943 Approved
0.7418 Intermediate Similarity NPD7286 Phase 2
0.7412 Intermediate Similarity NPD7390 Discontinued
0.7407 Intermediate Similarity NPD6859 Clinical (unspecified phase)
0.7387 Intermediate Similarity NPD7783 Phase 2
0.7387 Intermediate Similarity NPD7782 Clinical (unspecified phase)
0.7385 Intermediate Similarity NPD7435 Discontinued
0.7384 Intermediate Similarity NPD5403 Approved
0.738 Intermediate Similarity NPD8150 Discontinued
0.7374 Intermediate Similarity NPD8151 Discontinued
0.7368 Intermediate Similarity NPD5401 Approved
0.7349 Intermediate Similarity NPD651 Clinical (unspecified phase)
0.7341 Intermediate Similarity NPD1653 Approved
0.732 Intermediate Similarity NPD6776 Approved
0.732 Intermediate Similarity NPD6779 Approved
0.732 Intermediate Similarity NPD6780 Approved
0.732 Intermediate Similarity NPD6781 Approved
0.732 Intermediate Similarity NPD6777 Approved
0.732 Intermediate Similarity NPD6778 Approved
0.732 Intermediate Similarity NPD6782 Approved
0.7312 Intermediate Similarity NPD1203 Approved
0.7301 Intermediate Similarity NPD2313 Discontinued
0.7301 Intermediate Similarity NPD1699 Clinical (unspecified phase)
0.7299 Intermediate Similarity NPD5808 Clinical (unspecified phase)
0.7293 Intermediate Similarity NPD5242 Approved
0.7284 Intermediate Similarity NPD6832 Phase 2
0.7273 Intermediate Similarity NPD1899 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD1933 Approved
0.7268 Intermediate Similarity NPD3751 Discontinued
0.7238 Intermediate Similarity NPD7229 Phase 3
0.7222 Intermediate Similarity NPD9494 Approved
0.7209 Intermediate Similarity NPD6143 Clinical (unspecified phase)
0.7208 Intermediate Similarity NPD7697 Approved
0.7208 Intermediate Similarity NPD7698 Approved
0.7208 Intermediate Similarity NPD7696 Phase 3
0.7202 Intermediate Similarity NPD6100 Approved
0.7202 Intermediate Similarity NPD6099 Approved
0.7202 Intermediate Similarity NPD5408 Approved
0.7202 Intermediate Similarity NPD5406 Approved
0.7202 Intermediate Similarity NPD5405 Approved
0.7202 Intermediate Similarity NPD5404 Approved
0.7195 Intermediate Similarity NPD411 Approved
0.7193 Intermediate Similarity NPD6190 Approved
0.7182 Intermediate Similarity NPD8127 Discontinued
0.7172 Intermediate Similarity NPD7871 Phase 2
0.7172 Intermediate Similarity NPD7870 Phase 2
0.7164 Intermediate Similarity NPD7874 Approved
0.7164 Intermediate Similarity NPD7875 Clinical (unspecified phase)
0.716 Intermediate Similarity NPD2343 Clinical (unspecified phase)
0.716 Intermediate Similarity NPD2344 Approved
0.7143 Intermediate Similarity NPD4308 Phase 3
0.7126 Intermediate Similarity NPD6651 Approved
0.7126 Intermediate Similarity NPD1940 Clinical (unspecified phase)
0.7125 Intermediate Similarity NPD9717 Approved
0.7117 Intermediate Similarity NPD1530 Clinical (unspecified phase)
0.7112 Intermediate Similarity NPD7240 Approved
0.7108 Intermediate Similarity NPD4060 Phase 1
0.7108 Intermediate Similarity NPD1613 Approved
0.7108 Intermediate Similarity NPD1612 Clinical (unspecified phase)
0.7102 Intermediate Similarity NPD7458 Discontinued
0.7095 Intermediate Similarity NPD5353 Approved
0.7081 Intermediate Similarity NPD7177 Discontinued
0.7073 Intermediate Similarity NPD1529 Clinical (unspecified phase)
0.7071 Intermediate Similarity NPD6823 Phase 2
0.7069 Intermediate Similarity NPD7004 Clinical (unspecified phase)
0.7065 Intermediate Similarity NPD7701 Phase 2
0.7062 Intermediate Similarity NPD6535 Approved
0.7062 Intermediate Similarity NPD6534 Approved
0.7049 Intermediate Similarity NPD3787 Discontinued
0.7037 Intermediate Similarity NPD1283 Approved
0.7035 Intermediate Similarity NPD7003 Approved
0.703 Intermediate Similarity NPD4625 Phase 3
0.703 Intermediate Similarity NPD3027 Phase 3
0.7029 Intermediate Similarity NPD6273 Approved
0.7022 Intermediate Similarity NPD6386 Approved
0.7022 Intermediate Similarity NPD6385 Approved
0.7021 Intermediate Similarity NPD7685 Pre-registration
0.7019 Intermediate Similarity NPD1608 Approved
0.7019 Intermediate Similarity NPD9269 Phase 2
0.7005 Intermediate Similarity NPD8285 Discontinued
0.7 Intermediate Similarity NPD4476 Approved
0.7 Intermediate Similarity NPD4477 Approved
0.7 Intermediate Similarity NPD4288 Approved
0.7 Intermediate Similarity NPD2438 Suspended
0.6994 Remote Similarity NPD2309 Approved
0.699 Remote Similarity NPD8090 Clinical (unspecified phase)
0.6989 Remote Similarity NPD7893 Clinical (unspecified phase)
0.6988 Remote Similarity NPD3764 Approved
0.6988 Remote Similarity NPD3268 Approved
0.6984 Remote Similarity NPD4419 Clinical (unspecified phase)
0.6984 Remote Similarity NPD7549 Discontinued
0.6981 Remote Similarity NPD9268 Approved
0.6978 Remote Similarity NPD5537 Clinical (unspecified phase)
0.6961 Remote Similarity NPD7801 Approved
0.6959 Remote Similarity NPD1471 Phase 3
0.6957 Remote Similarity NPD1611 Approved
0.6957 Remote Similarity NPD422 Phase 1
0.6954 Remote Similarity NPD7699 Phase 2
0.6954 Remote Similarity NPD7700 Phase 2
0.6943 Remote Similarity NPD4287 Approved
0.6931 Remote Similarity NPD7039 Approved
0.6931 Remote Similarity NPD7038 Approved
0.6927 Remote Similarity NPD7615 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   23725
ChEMBL   CHEMBL176570
ZINC  

Physicochemical Properties

Molecular Weight:  358.07
ALogP:  0.0945
MLogP:  2.56
XLogP:  2.677
# Rotatable Bonds:  8
Polar Surface Area:  119.36
# H-Bond Aceptor:  4
# H-Bond Donor:  2
# Rings:  3
# Heavy Atoms:  26

Download Data

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General Info & Identifiers & Properties  
Structure MOL file  
Source Organisms  
Biological Activities  
Similar NPs/Drugs