Natural Product: NPC204385

Natural Product ID:  NPC204385
Common Name:   Cusparine
IUPAC Name:   2-[2-(1,3-benzodioxol-5-yl)ethyl]-4-methoxyquinoline
Synonyms:   Cusparine
Molecular Formula:   C19H17NO3
Standard InCHIKey:  RIXOVHWIYRZQDC-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C19H17NO3/c1-21-18-11-14(20-16-5-3-2-4-15(16)18)8-6-13-7-9-17-19(10-13)23-12-22-17/h2-5,7,9-11H,6,8,12H2,1H3
Canonical SMILES:  COc1cc(CCc2ccc3c(c2)OCO3)nc2c1cccc2
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
NPO18972 Astropecten indicus Species Astropectinidae Eukaryota UNPD*
NPO19680 Haminoea orteai Species Haminoeidae Eukaryota UNPD*
NPO14518 Ateleia herbert-smithii Species Fabaceae Eukaryota UNPD*
NPO16708 Pinus abies Species Pinaceae Eukaryota UNPD*
NPO16032 Xanthoparmelia quintaria Species Parmeliaceae Eukaryota UNPD*
NPO16452 Iochroma coccineum Species Solanaceae Eukaryota UNPD*
NPO19489 Tylosema esculentum Species Fabaceae Eukaryota UNPD*
NPO13657 Peperomia pellucida Species Piperaceae Eukaryota UNPD*
NPO83 Saccharina angustata Species Laminariaceae Eukaryota UNPD*
NPO18402 Tecoma peroba Species Bignoniaceae Eukaryota UNPD*
NPO17983 Nigrosabulum globosum Species Bionectriaceae Eukaryota UNPD*
NPO18897 Cephalosporium gregatum Species NA Eukaryota UNPD*
NPO17868 Eucryphia glutinosa Species Cunoniaceae Eukaryota UNPD*
NPO2401 Anisodus acutangulus Species Solanaceae Eukaryota TCMSP*
NPO26229 Convolvulus erinaceus Species Convolvulaceae Eukaryota TCMID*
NPO26163 Anisodus tanguticus Species Solanaceae Eukaryota TCMID*
NPO12160 Galipea officinalis Species Rutaceae Eukaryota TCMID*
NPO22406 Scopolia acutangula Species Solanaceae Eukaryota TCMID*
NPO21393 Datura inoxia Species Solanaceae Eukaryota TCMID*
NPO3735 Erythroxylum coca Species Erythroxylaceae Eukaryota TCMID*
NPO18781 Hyoscyamus niger Species Solanaceae Eukaryota TCMID*
NPO5091 Anisodus luridus Species Solanaceae Eukaryota TCMID*
NPO10276 Physochlaina physaloides Species Solanaceae Eukaryota TCMID*
NPO25993 Atropa belladonna Species Solanaceae Eukaryota TCMID*
NPO6495 Datura stramonium Species Solanaceae Eukaryota TCMID*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT1208 Organism Leishmania braziliensis Leishmania braziliensis IC90 = 100 ug/ml 10.1021/np50099a013
NPT580 Organism Trypanosoma cruzi Trypanosoma cruzi IC90 = 100 ug/ml 10.1021/np50099a013

  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 NPC204385 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
0.9758 High Similarity NPC206201
0.9455 High Similarity NPC312872
0.8791 High Similarity NPC234197
0.8788 High Similarity NPC26850
0.8606 High Similarity NPC26872
0.8587 High Similarity NPC477019
0.8579 High Similarity NPC296482
0.8579 High Similarity NPC202768
0.8579 High Similarity NPC53069
0.8511 High Similarity NPC313189
0.8385 Intermediate Similarity NPC171409
0.8385 Intermediate Similarity NPC96405
0.8316 Intermediate Similarity NPC135549
0.8306 Intermediate Similarity NPC195268
0.8306 Intermediate Similarity NPC133140
0.8299 Intermediate Similarity NPC235076
0.829 Intermediate Similarity NPC251160
0.8281 Intermediate Similarity NPC188420
0.8265 Intermediate Similarity NPC23614
0.8265 Intermediate Similarity NPC100079
0.8247 Intermediate Similarity NPC271215
0.8247 Intermediate Similarity NPC149471
0.8211 Intermediate Similarity NPC36229
0.8211 Intermediate Similarity NPC476581
0.8211 Intermediate Similarity NPC16452
0.8201 Intermediate Similarity NPC135887
0.8201 Intermediate Similarity NPC199277
0.815 Intermediate Similarity NPC118511
0.8138 Intermediate Similarity NPC4071
0.8138 Intermediate Similarity NPC476582
0.8138 Intermediate Similarity NPC476578
0.8131 Intermediate Similarity NPC46451
0.8092 Intermediate Similarity NPC177404
0.8053 Intermediate Similarity NPC31930
0.801 Intermediate Similarity NPC118121
0.799 Intermediate Similarity NPC204446
0.795 Intermediate Similarity NPC148409
0.7944 Intermediate Similarity NPC283152
0.7926 Intermediate Similarity NPC131017
0.7919 Intermediate Similarity NPC202605
0.7919 Intermediate Similarity NPC112206
0.7917 Intermediate Similarity NPC66815
0.7898 Intermediate Similarity NPC24954
0.7895 Intermediate Similarity NPC72211
0.7892 Intermediate Similarity NPC66083
0.7876 Intermediate Similarity NPC223427
0.7876 Intermediate Similarity NPC162484
0.7846 Intermediate Similarity NPC474595
0.7842 Intermediate Similarity NPC70956
0.7842 Intermediate Similarity NPC243834
0.7826 Intermediate Similarity NPC62069
0.7826 Intermediate Similarity NPC84478
0.7819 Intermediate Similarity NPC280964
0.7819 Intermediate Similarity NPC141915
0.7819 Intermediate Similarity NPC114335
0.7812 Intermediate Similarity NPC11017
0.7812 Intermediate Similarity NPC329747
0.7802 Intermediate Similarity NPC472168
0.779 Intermediate Similarity NPC288943
0.7789 Intermediate Similarity NPC70259
0.7789 Intermediate Similarity NPC266931
0.7784 Intermediate Similarity NPC42591
0.7778 Intermediate Similarity NPC279401
0.7778 Intermediate Similarity NPC79293
0.7745 Intermediate Similarity NPC280272
0.7744 Intermediate Similarity NPC285558
0.7737 Intermediate Similarity NPC205934
0.7737 Intermediate Similarity NPC43787
0.7727 Intermediate Similarity NPC219664
0.7716 Intermediate Similarity NPC470931
0.768 Intermediate Similarity NPC267423
0.7676 Intermediate Similarity NPC176127
0.7665 Intermediate Similarity NPC193777
0.766 Intermediate Similarity NPC242928
0.765 Intermediate Similarity NPC203168
0.7641 Intermediate Similarity NPC475085
0.7641 Intermediate Similarity NPC291535
0.7641 Intermediate Similarity NPC475112
0.7638 Intermediate Similarity NPC290689
0.763 Intermediate Similarity NPC253675
0.7624 Intermediate Similarity NPC258773
0.7622 Intermediate Similarity NPC474798
0.7614 Intermediate Similarity NPC304183
0.7612 Intermediate Similarity NPC474594
0.759 Intermediate Similarity NPC476044
0.7588 Intermediate Similarity NPC469589
0.7588 Intermediate Similarity NPC201697
0.7568 Intermediate Similarity NPC287588
0.7568 Intermediate Similarity NPC168486
0.7568 Intermediate Similarity NPC222592
0.7563 Intermediate Similarity NPC470930
0.7562 Intermediate Similarity NPC316981
0.7548 Intermediate Similarity NPC200888
0.754 Intermediate Similarity NPC179704
0.7538 Intermediate Similarity NPC475910
0.7538 Intermediate Similarity NPC329793
0.7525 Intermediate Similarity NPC236668
0.7525 Intermediate Similarity NPC162530
0.7525 Intermediate Similarity NPC476106
0.7525 Intermediate Similarity NPC472111
0.7524 Intermediate Similarity NPC278525
0.75 Intermediate Similarity NPC249405
0.75 Intermediate Similarity NPC232727
0.75 Intermediate Similarity NPC22481
0.7488 Intermediate Similarity NPC146976
0.7476 Intermediate Similarity NPC174049
0.7475 Intermediate Similarity NPC48353
0.7474 Intermediate Similarity NPC267928
0.7463 Intermediate Similarity NPC123976
0.7463 Intermediate Similarity NPC167860
0.7463 Intermediate Similarity NPC473822
0.7463 Intermediate Similarity NPC199667
0.7462 Intermediate Similarity NPC295898
0.7438 Intermediate Similarity NPC469592
0.7438 Intermediate Similarity NPC471080
0.7437 Intermediate Similarity NPC475841
0.7437 Intermediate Similarity NPC474145
0.7435 Intermediate Similarity NPC76748
0.743 Intermediate Similarity NPC108342
0.7424 Intermediate Similarity NPC475774
0.7418 Intermediate Similarity NPC473182
0.7415 Intermediate Similarity NPC473513
0.7413 Intermediate Similarity NPC174758
0.7413 Intermediate Similarity NPC473181
0.7411 Intermediate Similarity NPC470586
0.7409 Intermediate Similarity NPC307963
0.7409 Intermediate Similarity NPC475190
0.7407 Intermediate Similarity NPC168922
0.74 Intermediate Similarity NPC4687
0.7398 Intermediate Similarity NPC287437
0.7398 Intermediate Similarity NPC128823
0.7396 Intermediate Similarity NPC469390
0.7396 Intermediate Similarity NPC92111
0.7395 Intermediate Similarity NPC189903
0.7395 Intermediate Similarity NPC182907
0.7389 Intermediate Similarity NPC472098
0.7389 Intermediate Similarity NPC264176
0.7387 Intermediate Similarity NPC137929
0.7387 Intermediate Similarity NPC164374
0.7382 Intermediate Similarity NPC296527
0.738 Intermediate Similarity NPC85613
0.7379 Intermediate Similarity NPC173080
0.7379 Intermediate Similarity NPC473041
0.7376 Intermediate Similarity NPC471304
0.7368 Intermediate Similarity NPC61350
0.7361 Intermediate Similarity NPC166722
0.736 Intermediate Similarity NPC176538
0.7349 Intermediate Similarity NPC295228
0.7344 Intermediate Similarity NPC312531
0.7343 Intermediate Similarity NPC473179
0.734 Intermediate Similarity NPC208284
0.7327 Intermediate Similarity NPC209769
0.7321 Intermediate Similarity NPC303374
0.7321 Intermediate Similarity NPC122463
0.7316 Intermediate Similarity NPC94943
0.7315 Intermediate Similarity NPC473183
0.7313 Intermediate Similarity NPC249583
0.7302 Intermediate Similarity NPC473184
0.73 Intermediate Similarity NPC165349
0.73 Intermediate Similarity NPC264166
0.73 Intermediate Similarity NPC47059
0.73 Intermediate Similarity NPC118832
0.73 Intermediate Similarity NPC329708
0.73 Intermediate Similarity NPC274291
0.7296 Intermediate Similarity NPC474188
0.7295 Intermediate Similarity NPC469594
0.7295 Intermediate Similarity NPC96321
0.7291 Intermediate Similarity NPC470020
0.7287 Intermediate Similarity NPC478032
0.7287 Intermediate Similarity NPC283810
0.7277 Intermediate Similarity NPC82548
0.7273 Intermediate Similarity NPC19872
0.7273 Intermediate Similarity NPC315957
0.7268 Intermediate Similarity NPC478074
0.7264 Intermediate Similarity NPC300156
0.7264 Intermediate Similarity NPC323345
0.7264 Intermediate Similarity NPC470164
0.7263 Intermediate Similarity NPC190007
0.726 Intermediate Similarity NPC193267
0.726 Intermediate Similarity NPC213530
0.7255 Intermediate Similarity NPC87413
0.7254 Intermediate Similarity NPC474904
0.725 Intermediate Similarity NPC245816
0.725 Intermediate Similarity NPC469440
0.725 Intermediate Similarity NPC476138
0.7246 Intermediate Similarity NPC305984
0.7245 Intermediate Similarity NPC251090
0.7243 Intermediate Similarity NPC476999
0.7243 Intermediate Similarity NPC217176
0.7238 Intermediate Similarity NPC285635
0.7238 Intermediate Similarity NPC210434
0.7231 Intermediate Similarity NPC302001
0.723 Intermediate Similarity NPC476997
0.7225 Intermediate Similarity NPC60553
0.7222 Intermediate Similarity NPC18487
0.722 Intermediate Similarity NPC26679
0.722 Intermediate Similarity NPC94157
0.722 Intermediate Similarity NPC473180
0.7215 Intermediate Similarity NPC210296
0.7211 Intermediate Similarity NPC212535

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC204385 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
0.8837 High Similarity NPD3920 Phase 2
0.8579 High Similarity NPD3816 Phase 1
0.8579 High Similarity NPD3815 Phase 1
0.8466 Intermediate Similarity NPD5658 Approved
0.8306 Intermediate Similarity NPD3923 Approved
0.8306 Intermediate Similarity NPD3924 Approved
0.8306 Intermediate Similarity NPD3922 Approved
0.8306 Intermediate Similarity NPD3921 Approved
0.8222 Intermediate Similarity NPD5083 Clinical (unspecified phase)
0.8131 Intermediate Similarity NPD3763 Approved
0.8087 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.8061 Intermediate Similarity NPD7571 Clinical (unspecified phase)
0.7926 Intermediate Similarity NPD4418 Discontinued
0.7884 Intermediate Similarity NPD6550 Discontinued
0.7884 Intermediate Similarity NPD5512 Phase 3
0.7874 Intermediate Similarity NPD4885 Approved
0.7831 Intermediate Similarity NPD6861 Clinical (unspecified phase)
0.7831 Intermediate Similarity NPD6590 Discontinued
0.7755 Intermediate Similarity NPD7222 Phase 2
0.7749 Intermediate Similarity NPD6988 Phase 1
0.7735 Intermediate Similarity NPD1923 Clinical (unspecified phase)
0.7688 Intermediate Similarity NPD4889 Approved
0.7668 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7667 Intermediate Similarity NPD4724 Clinical (unspecified phase)
0.7665 Intermediate Similarity NPD5429 Discontinued
0.7647 Intermediate Similarity NPD5070 Clinical (unspecified phase)
0.7647 Intermediate Similarity NPD5930 Phase 3
0.7644 Intermediate Similarity NPD6491 Clinical (unspecified phase)
0.7629 Intermediate Similarity NPD6219 Discontinued
0.7585 Intermediate Similarity NPD7719 Discontinued
0.7576 Intermediate Similarity NPD7453 Approved
0.7576 Intermediate Similarity NPD7452 Approved
0.7574 Intermediate Similarity NPD5903 Approved
0.7574 Intermediate Similarity NPD5902 Approved
0.7539 Intermediate Similarity NPD6569 Phase 2
0.7528 Intermediate Similarity NPD2358 Clinical (unspecified phase)
0.7527 Intermediate Similarity NPD4203 Approved
0.7527 Intermediate Similarity NPD7414 Clinical (unspecified phase)
0.7527 Intermediate Similarity NPD4204 Approved
0.7525 Intermediate Similarity NPD6150 Discontinued
0.7514 Intermediate Similarity NPD6872 Clinical (unspecified phase)
0.7475 Intermediate Similarity NPD7069 Discontinued
0.7462 Intermediate Similarity NPD5669 Clinical (unspecified phase)
0.7461 Intermediate Similarity NPD3324 Clinical (unspecified phase)
0.7437 Intermediate Similarity NPD5530 Phase 1
0.7437 Intermediate Similarity NPD3003 Approved
0.7418 Intermediate Similarity NPD6494 Phase 2
0.7409 Intermediate Similarity NPD1038 Approved
0.7409 Intermediate Similarity NPD1304 Clinical (unspecified phase)
0.7407 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7404 Intermediate Similarity NPD1954 Phase 1
0.7395 Intermediate Similarity NPD5805 Approved
0.7389 Intermediate Similarity NPD4927 Discontinued
0.7385 Intermediate Similarity NPD6769 Clinical (unspecified phase)
0.7374 Intermediate Similarity NPD6208 Discontinued
0.7371 Intermediate Similarity NPD6251 Discontinued
0.735 Intermediate Similarity NPD4305 Clinical (unspecified phase)
0.7344 Intermediate Similarity NPD2410 Phase 2
0.734 Intermediate Similarity NPD3386 Phase 2
0.734 Intermediate Similarity NPD4502 Phase 2
0.7339 Intermediate Similarity NPD6517 Phase 3
0.731 Intermediate Similarity NPD3825 Phase 3
0.7302 Intermediate Similarity NPD6963 Approved
0.7302 Intermediate Similarity NPD5522 Clinical (unspecified phase)
0.7302 Intermediate Similarity NPD6964 Approved
0.73 Intermediate Similarity NPD4122 Approved
0.73 Intermediate Similarity NPD4038 Approved
0.73 Intermediate Similarity NPD31 Approved
0.73 Intermediate Similarity NPD32 Approved
0.73 Intermediate Similarity NPD4035 Approved
0.73 Intermediate Similarity NPD4795 Phase 2
0.73 Intermediate Similarity NPD4033 Approved
0.73 Intermediate Similarity NPD4036 Approved
0.73 Intermediate Similarity NPD4039 Approved
0.73 Intermediate Similarity NPD4034 Approved
0.73 Intermediate Similarity NPD4037 Approved
0.7282 Intermediate Similarity NPD5612 Discontinued
0.7277 Intermediate Similarity NPD4926 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD2917 Approved
0.7273 Intermediate Similarity NPD1740 Approved
0.7273 Intermediate Similarity NPD1739 Approved
0.7273 Intermediate Similarity NPD6159 Phase 2
0.7264 Intermediate Similarity NPD8403 Phase 1
0.7264 Intermediate Similarity NPD3842 Clinical (unspecified phase)
0.7258 Intermediate Similarity NPD5602 Clinical (unspecified phase)
0.7255 Intermediate Similarity NPD6567 Clinical (unspecified phase)
0.725 Intermediate Similarity NPD6991 Approved
0.7246 Intermediate Similarity NPD3440 Clinical (unspecified phase)
0.7243 Intermediate Similarity NPD4083 Discontinued
0.7243 Intermediate Similarity NPD4996 Approved
0.7243 Intermediate Similarity NPD4995 Approved
0.724 Intermediate Similarity NPD2749 Discontinued
0.7233 Intermediate Similarity NPD6140 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD1768 Approved
0.7213 Intermediate Similarity NPD2780 Approved
0.7213 Intermediate Similarity NPD2782 Approved
0.7212 Intermediate Similarity NPD7395 Discontinued
0.7204 Intermediate Similarity NPD677 Clinical (unspecified phase)
0.7202 Intermediate Similarity NPD7729 Clinical (unspecified phase)
0.7196 Intermediate Similarity NPD4925 Approved
0.7196 Intermediate Similarity NPD1900 Clinical (unspecified phase)
0.7194 Intermediate Similarity NPD3395 Approved
0.7194 Intermediate Similarity NPD3396 Approved
0.7191 Intermediate Similarity NPD6476 Clinical (unspecified phase)
0.7191 Intermediate Similarity NPD2882 Phase 1
0.7191 Intermediate Similarity NPD2883 Discontinued
0.7191 Intermediate Similarity NPD6158 Phase 2
0.7182 Intermediate Similarity NPD4875 Phase 3
0.7182 Intermediate Similarity NPD4876 Phase 3
0.7181 Intermediate Similarity NPD3503 Approved
0.7181 Intermediate Similarity NPD3504 Approved
0.7178 Intermediate Similarity NPD2060 Approved
0.7177 Intermediate Similarity NPD7194 Discontinued
0.7171 Intermediate Similarity NPD5067 Phase 2
0.7171 Intermediate Similarity NPD6220 Phase 3
0.7171 Intermediate Similarity NPD5066 Phase 2
0.7169 Intermediate Similarity NPD7025 Clinical (unspecified phase)
0.7157 Intermediate Similarity NPD3477 Phase 2
0.7157 Intermediate Similarity NPD3478 Clinical (unspecified phase)
0.7143 Intermediate Similarity NPD112 Approved
0.7143 Intermediate Similarity NPD9705 Discontinued
0.7136 Intermediate Similarity NPD3541 Clinical (unspecified phase)
0.7136 Intermediate Similarity NPD5866 Approved
0.7135 Intermediate Similarity NPD2781 Approved
0.7129 Intermediate Similarity NPD3397 Phase 2
0.7117 Intermediate Similarity NPD6230 Discontinued
0.7114 Intermediate Similarity NPD6477 Clinical (unspecified phase)
0.7108 Intermediate Similarity NPD7672 Approved
0.7108 Intermediate Similarity NPD5863 Clinical (unspecified phase)
0.7108 Intermediate Similarity NPD7671 Approved
0.7102 Intermediate Similarity NPD1305 Clinical (unspecified phase)
0.7098 Intermediate Similarity NPD5256 Discontinued
0.7092 Intermediate Similarity NPD4372 Phase 1
0.7091 Intermediate Similarity NPD5905 Phase 1
0.7087 Intermediate Similarity NPD5416 Discontinued
0.7083 Intermediate Similarity NPD6962 Phase 2
0.7081 Intermediate Similarity NPD7823 Clinical (unspecified phase)
0.7077 Intermediate Similarity NPD6281 Approved
0.7075 Intermediate Similarity NPD6824 Clinical (unspecified phase)
0.7067 Intermediate Similarity NPD5417 Clinical (unspecified phase)
0.7067 Intermediate Similarity NPD4897 Phase 2
0.7067 Intermediate Similarity NPD6243 Phase 3
0.7067 Intermediate Similarity NPD6244 Phase 3
0.7067 Intermediate Similarity NPD3257 Approved
0.7062 Intermediate Similarity NPD7678 Clinical (unspecified phase)
0.7059 Intermediate Similarity NPD5680 Clinical (unspecified phase)
0.7053 Intermediate Similarity NPD1503 Clinical (unspecified phase)
0.705 Intermediate Similarity NPD4548 Discontinued
0.7048 Intermediate Similarity NPD5632 Approved
0.7048 Intermediate Similarity NPD3354 Phase 2
0.7048 Intermediate Similarity NPD6985 Discontinued
0.7041 Intermediate Similarity NPD2334 Discontinued
0.7037 Intermediate Similarity NPD7589 Clinical (unspecified phase)
0.7033 Intermediate Similarity NPD6147 Clinical (unspecified phase)
0.7026 Intermediate Similarity NPD3349 Phase 2
0.702 Intermediate Similarity NPD3810 Clinical (unspecified phase)
0.7018 Intermediate Similarity NPD7558 Phase 2
0.7014 Intermediate Similarity NPD3258 Approved
0.7014 Intermediate Similarity NPD3875 Discontinued
0.701 Intermediate Similarity NPD4375 Approved
0.7 Intermediate Similarity NPD7955 Approved
0.7 Intermediate Similarity NPD7956 Approved
0.6995 Remote Similarity NPD6736 Discontinued
0.699 Remote Similarity NPD3408 Clinical (unspecified phase)
0.6985 Remote Similarity NPD5582 Discontinued
0.6981 Remote Similarity NPD6242 Discontinued
0.6979 Remote Similarity NPD3037 Phase 1
0.6976 Remote Similarity NPD1392 Approved
0.6972 Remote Similarity NPD7797 Approved
0.6972 Remote Similarity NPD7796 Approved
0.697 Remote Similarity NPD6046 Clinical (unspecified phase)
0.697 Remote Similarity NPD6228 Discontinued
0.697 Remote Similarity NPD4551 Phase 2
0.6967 Remote Similarity NPD4429 Discontinued
0.6961 Remote Similarity NPD3946 Clinical (unspecified phase)
0.6959 Remote Similarity NPD7567 Approved
0.6959 Remote Similarity NPD7424 Clinical (unspecified phase)
0.6954 Remote Similarity NPD1924 Approved
0.6951 Remote Similarity NPD5833 Phase 1
0.6951 Remote Similarity NPD5051 Phase 1
0.6947 Remote Similarity NPD4354 Approved
0.6944 Remote Similarity NPD3259 Approved
0.6944 Remote Similarity NPD6553 Clinical (unspecified phase)
0.6944 Remote Similarity NPD4328 Approved
0.6942 Remote Similarity NPD5529 Phase 1
0.6942 Remote Similarity NPD5528 Clinical (unspecified phase)
0.6942 Remote Similarity NPD2187 Approved
0.6942 Remote Similarity NPD2189 Approved
0.6931 Remote Similarity NPD4396 Clinical (unspecified phase)
0.693 Remote Similarity NPD6246 Approved
0.6923 Remote Similarity NPD4131 Phase 3
0.6923 Remote Similarity NPD7468 Clinical (unspecified phase)
0.6916 Remote Similarity NPD6160 Clinical (unspecified phase)
0.6915 Remote Similarity NPD6877 Discontinued
0.6912 Remote Similarity NPD7710 Clinical (unspecified phase)
0.6912 Remote Similarity NPD6324 Phase 1
0.6911 Remote Similarity NPD4072 Approved
0.6911 Remote Similarity NPD4071 Approved
0.6911 Remote Similarity NPD5670 Approved
0.6905 Remote Similarity NPD7538 Clinical (unspecified phase)

Structure

External Identifiers

PubChem CID   442893
ChEMBL   CHEMBL456954
ZINC  

Physicochemical Properties

Molecular Weight:  307.12
ALogP:  -0.0365
MLogP:  3.11
XLogP:  4.688
# Rotatable Bonds:  5
Polar Surface Area:  40.58
# H-Bond Aceptor:  1
# H-Bond Donor:  0
# Rings:  4
# Heavy Atoms:  23

Download Data

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Biological Activities  
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