Natural Product: NPC174672

Natural Product ID:  NPC174672
Common Name:   n.a.
IUPAC Name:  
Synonyms:  
Molecular Formula:   C15H10N2O2
Standard InCHIKey:  CJMWTIHSXJKZRH-UHFFFAOYSA-N
Standard InCHI:  InChI=1S/C15H10N2O2/c1-19-12-4-2-3-11-14(12)9-7-8-16-10-5-6-13(18)17(11)15(9)10/h2-8H,1H3
Canonical SMILES:  COc1cccc2c1c1ccnc3c1n2c(=O)cc3
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
NPO11873 Oecophylla smaragdina Species Formicidae Eukaryota UNPD*
NPO5303 Castanea crenata Species Fagaceae Eukaryota UNPD*
NPO12089 Trifolium alexandrinum Species Fabaceae Eukaryota UNPD*
NPO15146 Myrica nana Species Myricaceae Eukaryota UNPD*
NPO12717 Parmelia metastrigosa Species Parmeliaceae Eukaryota UNPD*
NPO14528 Pneumatospora obcoronata NA NA NA UNPD*
NPO26718 Chelidonura fulvipunctata Species Aglajidae Eukaryota UNPD*
NPO14948 Brucea javanica Species Simaroubaceae Eukaryota TCM_Taiwan*
NPO11084 Asplenium normale Species Aspleniaceae Eukaryota UNPD*
NPO14845 Ceratophyllum submersum Species Ceratophyllaceae Eukaryota UNPD*
NPO10818 Carpobrotus edulis Species Aizoaceae Eukaryota UNPD*
NPO21390 Zanthoxylum integrifoliolum Species Rutaceae Eukaryota fruit Lanyu Island, Taitung County, Taiwan PMID[10395498]
NPO11432 Centrolobium tomentosum Species Fabaceae Eukaryota UNPD*
NPO211 Aplysina cauliformis Species Aplysinidae Eukaryota UNPD*
NPO14150 Solanum jamaicense Species Solanaceae Eukaryota UNPD*
NPO11637 Psilostrophe cooperi Species Asteraceae Eukaryota UNPD*
NPO1641 Amycolatopsis azurea Species Pseudonocardiaceae Bacteria UNPD*
NPO15520 Dracocephalum kotschyi Species Lamiaceae Eukaryota UNPD*
NPO14749 Lippia carviodora Species Verbenaceae Eukaryota UNPD*
NPO3164 Yponomeuta malinellus Species Yponomeutidae Eukaryota UNPD*
NPO12944 Sideritis tragoriganum Species Lamiaceae Eukaryota UNPD*
NPO9203 Cephalonomia gallicola Species Bethylidae Eukaryota UNPD*
NPO14948 Brucea javanica Species Simaroubaceae Eukaryota UNPD*

  Biological Activity

Target ID Target Type Target Name Target Organism Activity Type Activity Relation Value Unit Reference
NPT177 Tissue Aorta Rattus norvegicus Activity = 78.9 % 10395498
NPT177 Tissue Aorta Rattus norvegicus Activity = 88.4 % 10395498
NPT177 Tissue Aorta Rattus norvegicus Activity = 74.5 % 10395498
NPT177 Tissue Aorta Rattus norvegicus Activity = 57.9 % 10395498
NPT2 Others Unspecified Activity = 90.3 % 10395498
NPT2 Others Unspecified Activity = 80.4 % 10395498
NPT2 Others Unspecified Activity = 76.3 % 10395498
NPT2 Others Unspecified Activity = 84.8 % 10395498

  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 NPC174672 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
0.9681 High Similarity NPC174758
0.9421 High Similarity NPC82548
0.9381 High Similarity NPC274982
0.9319 High Similarity NPC287208
0.9211 High Similarity NPC200836
0.8912 High Similarity NPC53144
0.8737 High Similarity NPC198673
0.8667 High Similarity NPC211813
0.8643 High Similarity NPC85273
0.8615 High Similarity NPC232727
0.8571 High Similarity NPC295898
0.8557 High Similarity NPC168911
0.8557 High Similarity NPC239954
0.8505 High Similarity NPC267928
0.838 Intermediate Similarity NPC99891
0.8376 Intermediate Similarity NPC176538
0.8366 Intermediate Similarity NPC167860
0.8366 Intermediate Similarity NPC123976
0.83 Intermediate Similarity NPC285558
0.8283 Intermediate Similarity NPC19872
0.8274 Intermediate Similarity NPC212213
0.8271 Intermediate Similarity NPC141053
0.8238 Intermediate Similarity NPC122436
0.823 Intermediate Similarity NPC60621
0.823 Intermediate Similarity NPC310118
0.8221 Intermediate Similarity NPC213530
0.8221 Intermediate Similarity NPC193267
0.8191 Intermediate Similarity NPC121772
0.8173 Intermediate Similarity NPC13880
0.8069 Intermediate Similarity NPC245816
0.8069 Intermediate Similarity NPC476138
0.8049 Intermediate Similarity NPC185782
0.8048 Intermediate Similarity NPC17565
0.8037 Intermediate Similarity NPC110151
0.8019 Intermediate Similarity NPC264176
0.801 Intermediate Similarity NPC12649
0.801 Intermediate Similarity NPC315957
0.8009 Intermediate Similarity NPC260434
0.8009 Intermediate Similarity NPC128115
0.7991 Intermediate Similarity NPC235685
0.7956 Intermediate Similarity NPC26543
0.7955 Intermediate Similarity NPC101350
0.7937 Intermediate Similarity NPC472434
0.7933 Intermediate Similarity NPC26679
0.7917 Intermediate Similarity NPC314954
0.7905 Intermediate Similarity NPC148183
0.7905 Intermediate Similarity NPC152768
0.7897 Intermediate Similarity NPC65277
0.7895 Intermediate Similarity NPC476287
0.7892 Intermediate Similarity NPC293487
0.7884 Intermediate Similarity NPC476518
0.7861 Intermediate Similarity NPC478182
0.7854 Intermediate Similarity NPC16452
0.7854 Intermediate Similarity NPC476581
0.7854 Intermediate Similarity NPC36229
0.7846 Intermediate Similarity NPC84478
0.7842 Intermediate Similarity NPC14651
0.7842 Intermediate Similarity NPC121658
0.7834 Intermediate Similarity NPC471762
0.782 Intermediate Similarity NPC470799
0.782 Intermediate Similarity NPC170114
0.782 Intermediate Similarity NPC8022
0.7789 Intermediate Similarity NPC92111
0.7788 Intermediate Similarity NPC469589
0.7784 Intermediate Similarity NPC24864
0.7778 Intermediate Similarity NPC296527
0.7773 Intermediate Similarity NPC470549
0.7762 Intermediate Similarity NPC53069
0.7762 Intermediate Similarity NPC202768
0.7762 Intermediate Similarity NPC296482
0.7752 Intermediate Similarity NPC66777
0.7745 Intermediate Similarity NPC234197
0.7739 Intermediate Similarity NPC76748
0.7739 Intermediate Similarity NPC472435
0.7718 Intermediate Similarity NPC475774
0.7713 Intermediate Similarity NPC478185
0.7713 Intermediate Similarity NPC177404
0.7713 Intermediate Similarity NPC30540
0.7711 Intermediate Similarity NPC307963
0.7708 Intermediate Similarity NPC111624
0.7707 Intermediate Similarity NPC31930
0.77 Intermediate Similarity NPC305984
0.7696 Intermediate Similarity NPC81535
0.7696 Intermediate Similarity NPC287437
0.7696 Intermediate Similarity NPC32534
0.7684 Intermediate Similarity NPC478183
0.7678 Intermediate Similarity NPC171409
0.7678 Intermediate Similarity NPC96405
0.7675 Intermediate Similarity NPC91868
0.7675 Intermediate Similarity NPC63971
0.7672 Intermediate Similarity NPC478184
0.7667 Intermediate Similarity NPC11464
0.7659 Intermediate Similarity NPC477019
0.765 Intermediate Similarity NPC322482
0.7647 Intermediate Similarity NPC26850
0.7647 Intermediate Similarity NPC469554
0.7644 Intermediate Similarity NPC238457
0.7644 Intermediate Similarity NPC472111
0.7639 Intermediate Similarity NPC472436
0.7635 Intermediate Similarity NPC251090
0.763 Intermediate Similarity NPC208284
0.7626 Intermediate Similarity NPC157931
0.7624 Intermediate Similarity NPC106937
0.7614 Intermediate Similarity NPC176127
0.761 Intermediate Similarity NPC476578
0.761 Intermediate Similarity NPC4071
0.761 Intermediate Similarity NPC476582
0.7604 Intermediate Similarity NPC91895
0.7596 Intermediate Similarity NPC475070
0.7594 Intermediate Similarity NPC472098
0.7594 Intermediate Similarity NPC202605
0.7594 Intermediate Similarity NPC112206
0.7593 Intermediate Similarity NPC472099
0.7583 Intermediate Similarity NPC470020
0.7581 Intermediate Similarity NPC303658
0.7581 Intermediate Similarity NPC26872
0.7578 Intermediate Similarity NPC253675
0.7576 Intermediate Similarity NPC284678
0.7574 Intermediate Similarity NPC133140
0.7574 Intermediate Similarity NPC195268
0.7573 Intermediate Similarity NPC329747
0.7568 Intermediate Similarity NPC101543
0.7563 Intermediate Similarity NPC161887
0.7563 Intermediate Similarity NPC219963
0.7563 Intermediate Similarity NPC266551
0.7562 Intermediate Similarity NPC134079
0.756 Intermediate Similarity NPC470164
0.756 Intermediate Similarity NPC323345
0.7559 Intermediate Similarity NPC162530
0.7549 Intermediate Similarity NPC194967
0.7549 Intermediate Similarity NPC242209
0.7548 Intermediate Similarity NPC223427
0.7535 Intermediate Similarity NPC473513
0.7524 Intermediate Similarity NPC313189
0.7512 Intermediate Similarity NPC323969
0.75 Intermediate Similarity NPC100079
0.75 Intermediate Similarity NPC173080
0.75 Intermediate Similarity NPC23614
0.75 Intermediate Similarity NPC5145
0.75 Intermediate Similarity NPC131017
0.7488 Intermediate Similarity NPC324149
0.7477 Intermediate Similarity NPC471080
0.7477 Intermediate Similarity NPC469592
0.7476 Intermediate Similarity NPC476124
0.7476 Intermediate Similarity NPC476121
0.7476 Intermediate Similarity NPC72211
0.7474 Intermediate Similarity NPC285635
0.7467 Intermediate Similarity NPC477549
0.7467 Intermediate Similarity NPC295228
0.7465 Intermediate Similarity NPC292958
0.7465 Intermediate Similarity NPC46451
0.7463 Intermediate Similarity NPC46580
0.7455 Intermediate Similarity NPC21638
0.745 Intermediate Similarity NPC20249
0.7442 Intermediate Similarity NPC235076
0.7441 Intermediate Similarity NPC135549
0.7441 Intermediate Similarity NPC193238
0.744 Intermediate Similarity NPC476167
0.7432 Intermediate Similarity NPC194740
0.7431 Intermediate Similarity NPC477533
0.743 Intermediate Similarity NPC316981
0.7421 Intermediate Similarity NPC227908
0.7416 Intermediate Similarity NPC57398
0.7412 Intermediate Similarity NPC148889
0.7406 Intermediate Similarity NPC475910
0.7405 Intermediate Similarity NPC478186
0.7404 Intermediate Similarity NPC11017
0.7395 Intermediate Similarity NPC234078
0.7395 Intermediate Similarity NPC221100
0.7391 Intermediate Similarity NPC474916
0.7391 Intermediate Similarity NPC192315
0.7383 Intermediate Similarity NPC146418
0.7381 Intermediate Similarity NPC162484
0.7379 Intermediate Similarity NPC70259
0.7376 Intermediate Similarity NPC74382
0.7376 Intermediate Similarity NPC206251
0.7349 Intermediate Similarity NPC251160
0.7349 Intermediate Similarity NPC118940
0.7346 Intermediate Similarity NPC165349
0.7346 Intermediate Similarity NPC470500
0.7346 Intermediate Similarity NPC47059
0.7346 Intermediate Similarity NPC274291
0.7346 Intermediate Similarity NPC264166
0.7346 Intermediate Similarity NPC329708
0.7346 Intermediate Similarity NPC118832
0.7343 Intermediate Similarity NPC243834
0.7343 Intermediate Similarity NPC224928
0.7343 Intermediate Similarity NPC70956
0.7339 Intermediate Similarity NPC469594
0.7336 Intermediate Similarity NPC290689
0.7336 Intermediate Similarity NPC269367
0.733 Intermediate Similarity NPC205934
0.733 Intermediate Similarity NPC43787
0.7325 Intermediate Similarity NPC474183
0.7324 Intermediate Similarity NPC470931
0.7321 Intermediate Similarity NPC329793
0.7316 Intermediate Similarity NPC78609
0.7315 Intermediate Similarity NPC236668
0.7315 Intermediate Similarity NPC149471
0.7315 Intermediate Similarity NPC271215

  Similar Clinical/Approved Drugs

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

●  The left chart: Distribution of similarity level between NPC174672 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
0.8119 Intermediate Similarity NPD4795 Phase 2
0.8112 Intermediate Similarity NPD4372 Phase 1
0.8038 Intermediate Similarity NPD7823 Clinical (unspecified phase)
0.801 Intermediate Similarity NPD1739 Approved
0.801 Intermediate Similarity NPD1740 Approved
0.8 Intermediate Similarity NPD2921 Clinical (unspecified phase)
0.7964 Intermediate Similarity NPD6790 Phase 1
0.7907 Intermediate Similarity NPD7426 Phase 1
0.7889 Intermediate Similarity NPD1304 Clinical (unspecified phase)
0.7797 Intermediate Similarity NPD5482 Discontinued
0.7762 Intermediate Similarity NPD3816 Phase 1
0.7762 Intermediate Similarity NPD3815 Phase 1
0.7757 Intermediate Similarity NPD6242 Discontinued
0.774 Intermediate Similarity NPD5658 Approved
0.7718 Intermediate Similarity NPD5513 Phase 2
0.7711 Intermediate Similarity NPD1038 Approved
0.7692 Intermediate Similarity NPD1392 Approved
0.7644 Intermediate Similarity NPD5530 Phase 1
0.7644 Intermediate Similarity NPD5601 Phase 2
0.763 Intermediate Similarity NPD6567 Clinical (unspecified phase)
0.7624 Intermediate Similarity NPD802 Phase 2
0.7591 Intermediate Similarity NPD5559 Phase 2
0.7586 Intermediate Similarity NPD4418 Discontinued
0.7574 Intermediate Similarity NPD3924 Approved
0.7574 Intermediate Similarity NPD3923 Approved
0.7574 Intermediate Similarity NPD3922 Approved
0.7574 Intermediate Similarity NPD3921 Approved
0.7565 Intermediate Similarity NPD1078 Clinical (unspecified phase)
0.7563 Intermediate Similarity NPD4204 Approved
0.7563 Intermediate Similarity NPD3386 Phase 2
0.7563 Intermediate Similarity NPD4203 Approved
0.7554 Intermediate Similarity NPD6961 Discontinued
0.7544 Intermediate Similarity NPD5483 Clinical (unspecified phase)
0.7534 Intermediate Similarity NPD7558 Phase 2
0.7522 Intermediate Similarity NPD4558 Phase 2
0.75 Intermediate Similarity NPD7675 Phase 3
0.75 Intermediate Similarity NPD7676 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD6861 Clinical (unspecified phase)
0.75 Intermediate Similarity NPD7674 Phase 3
0.7488 Intermediate Similarity NPD4396 Clinical (unspecified phase)
0.7477 Intermediate Similarity NPD4952 Phase 3
0.7476 Intermediate Similarity NPD3003 Approved
0.7465 Intermediate Similarity NPD3763 Approved
0.745 Intermediate Similarity NPD4889 Approved
0.7441 Intermediate Similarity NPD7222 Phase 2
0.7434 Intermediate Similarity NPD4958 Clinical (unspecified phase)
0.7429 Intermediate Similarity NPD3397 Phase 2
0.7424 Intermediate Similarity NPD7067 Approved
0.7424 Intermediate Similarity NPD7068 Approved
0.7414 Intermediate Similarity NPD6525 Clinical (unspecified phase)
0.7406 Intermediate Similarity NPD5450 Discontinued
0.7402 Intermediate Similarity NPD6569 Phase 2
0.7399 Intermediate Similarity NPD6968 Phase 2
0.7399 Intermediate Similarity NPD6969 Phase 2
0.7393 Intermediate Similarity NPD4926 Clinical (unspecified phase)
0.7385 Intermediate Similarity NPD7194 Discontinued
0.7383 Intermediate Similarity NPD3570 Phase 2
0.7378 Intermediate Similarity NPD6223 Clinical (unspecified phase)
0.7378 Intermediate Similarity NPD4373 Phase 2
0.7376 Intermediate Similarity NPD1033 Clinical (unspecified phase)
0.7376 Intermediate Similarity NPD1034 Phase 3
0.7371 Intermediate Similarity NPD6872 Clinical (unspecified phase)
0.7361 Intermediate Similarity NPD6140 Clinical (unspecified phase)
0.7356 Intermediate Similarity NPD1768 Approved
0.7356 Intermediate Similarity NPD4118 Clinical (unspecified phase)
0.7353 Intermediate Similarity NPD2334 Discontinued
0.7352 Intermediate Similarity NPD5930 Phase 3
0.7352 Intermediate Similarity NPD8479 Phase 2
0.7346 Intermediate Similarity NPD4039 Approved
0.7346 Intermediate Similarity NPD4036 Approved
0.7346 Intermediate Similarity NPD4033 Approved
0.7346 Intermediate Similarity NPD4034 Approved
0.7346 Intermediate Similarity NPD31 Approved
0.7346 Intermediate Similarity NPD4037 Approved
0.7346 Intermediate Similarity NPD4122 Approved
0.7346 Intermediate Similarity NPD32 Approved
0.7346 Intermediate Similarity NPD4038 Approved
0.7346 Intermediate Similarity NPD4035 Approved
0.7345 Intermediate Similarity NPD2757 Phase 2
0.7343 Intermediate Similarity NPD1622 Discontinued
0.7343 Intermediate Similarity NPD2952 Discontinued
0.7339 Intermediate Similarity NPD5632 Approved
0.7339 Intermediate Similarity NPD5948 Phase 2
0.733 Intermediate Similarity NPD6306 Phase 2
0.7324 Intermediate Similarity NPD5863 Clinical (unspecified phase)
0.7318 Intermediate Similarity NPD4923 Phase 1
0.7309 Intermediate Similarity NPD7268 Clinical (unspecified phase)
0.7302 Intermediate Similarity NPD3939 Suspended
0.7302 Intermediate Similarity NPD5066 Phase 2
0.7302 Intermediate Similarity NPD5067 Phase 2
0.73 Intermediate Similarity NPD7414 Clinical (unspecified phase)
0.7295 Intermediate Similarity NPD3477 Phase 2
0.7295 Intermediate Similarity NPD3478 Clinical (unspecified phase)
0.7293 Intermediate Similarity NPD7025 Clinical (unspecified phase)
0.7285 Intermediate Similarity NPD6824 Clinical (unspecified phase)
0.7282 Intermediate Similarity NPD5575 Clinical (unspecified phase)
0.7281 Intermediate Similarity NPD5293 Phase 2
0.7281 Intermediate Similarity NPD5902 Approved
0.7281 Intermediate Similarity NPD5903 Approved
0.7281 Intermediate Similarity NPD4897 Phase 2
0.7277 Intermediate Similarity NPD7452 Approved
0.7277 Intermediate Similarity NPD7710 Clinical (unspecified phase)
0.7277 Intermediate Similarity NPD7453 Approved
0.7277 Intermediate Similarity NPD7424 Clinical (unspecified phase)
0.7273 Intermediate Similarity NPD3825 Phase 3
0.7269 Intermediate Similarity NPD7069 Discontinued
0.7269 Intermediate Similarity NPD6963 Approved
0.7269 Intermediate Similarity NPD6964 Approved
0.7261 Intermediate Similarity NPD8284 Discontinued
0.726 Intermediate Similarity NPD4899 Clinical (unspecified phase)
0.726 Intermediate Similarity NPD6568 Discontinued
0.7256 Intermediate Similarity NPD4900 Clinical (unspecified phase)
0.7249 Intermediate Similarity NPD7729 Clinical (unspecified phase)
0.7246 Intermediate Similarity NPD3396 Approved
0.7246 Intermediate Similarity NPD3395 Approved
0.7244 Intermediate Similarity NPD5801 Clinical (unspecified phase)
0.7244 Intermediate Similarity NPD7589 Clinical (unspecified phase)
0.7243 Intermediate Similarity NPD2916 Discontinued
0.724 Intermediate Similarity NPD5507 Approved
0.724 Intermediate Similarity NPD4881 Clinical (unspecified phase)
0.724 Intermediate Similarity NPD5506 Approved
0.7238 Intermediate Similarity NPD5867 Clinical (unspecified phase)
0.723 Intermediate Similarity NPD4901 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD5040 Clinical (unspecified phase)
0.7225 Intermediate Similarity NPD4987 Clinical (unspecified phase)
0.7222 Intermediate Similarity NPD6172 Clinical (unspecified phase)
0.722 Intermediate Similarity NPD3321 Discontinued
0.7215 Intermediate Similarity NPD8246 Approved
0.7215 Intermediate Similarity NPD8247 Approved
0.721 Intermediate Similarity NPD5488 Discontinued
0.7202 Intermediate Similarity NPD3257 Approved
0.72 Intermediate Similarity NPD7555 Discontinued
0.7198 Intermediate Similarity NPD6572 Phase 2
0.7198 Intermediate Similarity NPD6573 Phase 3
0.719 Intermediate Similarity NPD6999 Discontinued
0.719 Intermediate Similarity NPD7000 Clinical (unspecified phase)
0.7182 Intermediate Similarity NPD4429 Discontinued
0.7182 Intermediate Similarity NPD3354 Phase 2
0.7181 Intermediate Similarity NPD7796 Approved
0.7181 Intermediate Similarity NPD7797 Approved
0.7168 Intermediate Similarity NPD8512 Phase 3
0.7167 Intermediate Similarity NPD6230 Discontinued
0.7163 Intermediate Similarity NPD2189 Approved
0.7163 Intermediate Similarity NPD3324 Clinical (unspecified phase)
0.7163 Intermediate Similarity NPD2187 Approved
0.7163 Intermediate Similarity NPD7467 Discontinued
0.7157 Intermediate Similarity NPD4375 Approved
0.7156 Intermediate Similarity NPD3259 Approved
0.7155 Intermediate Similarity NPD8091 Phase 3
0.715 Intermediate Similarity NPD1032 Phase 2
0.7143 Intermediate Similarity NPD3938 Phase 1
0.7136 Intermediate Similarity NPD4989 Phase 2
0.7136 Intermediate Similarity NPD6281 Approved
0.713 Intermediate Similarity NPD1856 Discontinued
0.7117 Intermediate Similarity NPD6856 Discontinued
0.7114 Intermediate Similarity NPD1620 Clinical (unspecified phase)
0.7114 Intermediate Similarity NPD3920 Phase 2
0.7109 Intermediate Similarity NPD4548 Discontinued
0.7108 Intermediate Similarity NPD6344 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD7705 Clinical (unspecified phase)
0.7105 Intermediate Similarity NPD4885 Approved
0.7104 Intermediate Similarity NPD6985 Discontinued
0.7095 Intermediate Similarity NPD5116 Phase 1
0.7095 Intermediate Similarity NPD6769 Clinical (unspecified phase)
0.7093 Intermediate Similarity NPD7567 Approved
0.7092 Intermediate Similarity NPD2915 Discontinued
0.7091 Intermediate Similarity NPD5612 Discontinued
0.7091 Intermediate Similarity NPD2412 Clinical (unspecified phase)
0.7091 Intermediate Similarity NPD7112 Discontinued
0.7083 Intermediate Similarity NPD7666 Phase 3
0.7083 Intermediate Similarity NPD7665 Phase 2
0.7079 Intermediate Similarity NPD2601 Approved
0.7079 Intermediate Similarity NPD2600 Approved
0.7079 Intermediate Similarity NPD2599 Approved
0.7076 Intermediate Similarity NPD4369 Phase 2
0.7074 Intermediate Similarity NPD2471 Approved
0.7074 Intermediate Similarity NPD6741 Clinical (unspecified phase)
0.7074 Intermediate Similarity NPD6494 Phase 2
0.7074 Intermediate Similarity NPD4850 Phase 1
0.7074 Intermediate Similarity NPD2472 Approved
0.7072 Intermediate Similarity NPD3258 Approved
0.707 Intermediate Similarity NPD3932 Clinical (unspecified phase)
0.707 Intermediate Similarity NPD7001 Phase 3
0.7069 Intermediate Similarity NPD8016 Phase 3
0.7069 Intermediate Similarity NPD8017 Clinical (unspecified phase)
0.7067 Intermediate Similarity NPD6247 Clinical (unspecified phase)
0.7065 Intermediate Similarity NPD5751 Clinical (unspecified phase)
0.7064 Intermediate Similarity NPD8100 Phase 3
0.7054 Intermediate Similarity NPD7219 Approved
0.7054 Intermediate Similarity NPD7221 Approved
0.7052 Intermediate Similarity NPD7416 Clinical (unspecified phase)
0.7042 Intermediate Similarity NPD8049 Phase 2
0.7039 Intermediate Similarity NPD6257 Clinical (unspecified phase)
0.7035 Intermediate Similarity NPD7051 Phase 3
0.7035 Intermediate Similarity NPD7603 Discontinued
0.7035 Intermediate Similarity NPD7050 Clinical (unspecified phase)
0.7027 Intermediate Similarity NPD8405 Clinical (unspecified phase)
0.7026 Intermediate Similarity NPD112 Approved
0.7026 Intermediate Similarity NPD9705 Discontinued
0.7025 Intermediate Similarity NPD6530 Approved

Structure

External Identifiers

PubChem CID   14463028
ChEMBL   CHEMBL513557
ZINC  

Physicochemical Properties

Molecular Weight:  250.07
ALogP:  -0.3255
MLogP:  2.67
XLogP:  2.154
# Rotatable Bonds:  2
Polar Surface Area:  44.12
# H-Bond Aceptor:  3
# H-Bond Donor:  0
# Rings:  4
# Heavy Atoms:  19

Download Data

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