Drug Information

Drug ID:  NPD1183
Drug Name:  Bromazepam
Molecular Formula:  C14H10BrN3O
Canonical SMILES:  Brc1ccc2c(c1)C(=NCC(=N2)O)c1ccccn1
Standard InCHI:  InChI=1S/C14H10BrN3O/c15-9-4-5-11-10(7-9)14(17-8-13(19)18-11)12-3-1-2-6-16-12/h1-7H,8H2,(H,18,19)
Standard InCHIKey:  VMIYHDSEFNYJSL-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD1183

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
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Similarity Level Similarity Score Natural Product ID
Intermediate Similarity 0.8367 NPC316811
Intermediate Similarity 0.8194 NPC34844
Intermediate Similarity 0.8158 NPC316069
Intermediate Similarity 0.8138 NPC256893
Intermediate Similarity 0.8085 NPC46358
Intermediate Similarity 0.8025 NPC97343
Intermediate Similarity 0.795 NPC280864
Intermediate Similarity 0.7785 NPC141926
Intermediate Similarity 0.7778 NPC149265
Intermediate Similarity 0.7748 NPC314102
Intermediate Similarity 0.7748 NPC251722
Intermediate Similarity 0.773 NPC274229
Intermediate Similarity 0.773 NPC91958
Intermediate Similarity 0.7727 NPC190296
Intermediate Similarity 0.7683 NPC109447
Intermediate Similarity 0.7628 NPC314372
Intermediate Similarity 0.7628 NPC159856
Intermediate Similarity 0.7582 NPC169433
Intermediate Similarity 0.7562 NPC232798
Intermediate Similarity 0.756 NPC280297
Intermediate Similarity 0.7547 NPC40070
Intermediate Similarity 0.7545 NPC82331
Intermediate Similarity 0.7532 NPC470111
Intermediate Similarity 0.7531 NPC129721
Intermediate Similarity 0.7515 NPC195507
Intermediate Similarity 0.7515 NPC17751
Intermediate Similarity 0.7483 NPC143603
Intermediate Similarity 0.7467 NPC282398
Intermediate Similarity 0.7466 NPC290094
Intermediate Similarity 0.7465 NPC148140
Intermediate Similarity 0.7451 NPC96102
Intermediate Similarity 0.7438 NPC24678
Intermediate Similarity 0.7438 NPC105818
Intermediate Similarity 0.743 NPC179701
Intermediate Similarity 0.7421 NPC471957
Intermediate Similarity 0.7417 NPC324611
Intermediate Similarity 0.7413 NPC81561
Intermediate Similarity 0.7413 NPC240136
Intermediate Similarity 0.7413 NPC471402
Intermediate Similarity 0.7413 NPC297486
Intermediate Similarity 0.7412 NPC474958
Intermediate Similarity 0.7412 NPC121903
Intermediate Similarity 0.7403 NPC105127
Intermediate Similarity 0.7403 NPC84911
Intermediate Similarity 0.7403 NPC150259
Intermediate Similarity 0.7396 NPC288074
Intermediate Similarity 0.7391 NPC470505
Intermediate Similarity 0.7389 NPC262898
Intermediate Similarity 0.7383 NPC471313
Intermediate Similarity 0.7383 NPC471311
Intermediate Similarity 0.7365 NPC166424
Intermediate Similarity 0.7365 NPC245244
Intermediate Similarity 0.7365 NPC478183
Intermediate Similarity 0.7365 NPC146373
Intermediate Similarity 0.7361 NPC54102
Intermediate Similarity 0.7361 NPC162689
Intermediate Similarity 0.7358 NPC63545
Intermediate Similarity 0.7356 NPC108011
Intermediate Similarity 0.7346 NPC469763
Intermediate Similarity 0.7346 NPC469786
Intermediate Similarity 0.7346 NPC469765
Intermediate Similarity 0.7346 NPC469760
Intermediate Similarity 0.7346 NPC73952
Intermediate Similarity 0.7346 NPC259644
Intermediate Similarity 0.7346 NPC25008
Intermediate Similarity 0.7338 NPC29886
Intermediate Similarity 0.7338 NPC261195
Intermediate Similarity 0.7333 NPC279918
Intermediate Similarity 0.7329 NPC182570
Intermediate Similarity 0.7329 NPC265605
Intermediate Similarity 0.7329 NPC48564
Intermediate Similarity 0.7315 NPC169625
Intermediate Similarity 0.7315 NPC202957
Intermediate Similarity 0.7312 NPC469811
Intermediate Similarity 0.7312 NPC201380
Intermediate Similarity 0.7312 NPC179787
Intermediate Similarity 0.7308 NPC73767
Intermediate Similarity 0.7308 NPC110126
Intermediate Similarity 0.7308 NPC315348
Intermediate Similarity 0.7308 NPC32002
Intermediate Similarity 0.7303 NPC82295
Intermediate Similarity 0.7301 NPC75540
Intermediate Similarity 0.7301 NPC212376
Intermediate Similarity 0.7301 NPC80597
Intermediate Similarity 0.7301 NPC70922
Intermediate Similarity 0.7301 NPC211572
Intermediate Similarity 0.7297 NPC476322
Intermediate Similarity 0.7296 NPC285731
Intermediate Similarity 0.7294 NPC64055
Intermediate Similarity 0.7294 NPC477611
Intermediate Similarity 0.7289 NPC282231
Intermediate Similarity 0.7286 NPC27802
Intermediate Similarity 0.7284 NPC216713
Intermediate Similarity 0.7273 NPC92796
Intermediate Similarity 0.7273 NPC135141
Intermediate Similarity 0.7273 NPC6436
Intermediate Similarity 0.7273 NPC293487
Intermediate Similarity 0.7267 NPC321911
Intermediate Similarity 0.7263 NPC477166
Intermediate Similarity 0.7263 NPC477167
Intermediate Similarity 0.7263 NPC473342
Intermediate Similarity 0.7263 NPC304187
Intermediate Similarity 0.7261 NPC469779
Intermediate Similarity 0.7261 NPC469761
Intermediate Similarity 0.7261 NPC469784
Intermediate Similarity 0.7261 NPC469783
Intermediate Similarity 0.7261 NPC469767
Intermediate Similarity 0.7261 NPC469768
Intermediate Similarity 0.7261 NPC469780
Intermediate Similarity 0.7261 NPC279081
Intermediate Similarity 0.726 NPC215519
Intermediate Similarity 0.7256 NPC469785
Intermediate Similarity 0.7241 NPC307191
Intermediate Similarity 0.7225 NPC233050
Intermediate Similarity 0.7225 NPC276540
Intermediate Similarity 0.7219 NPC89490
Intermediate Similarity 0.7215 NPC469766
Intermediate Similarity 0.7212 NPC469762
Intermediate Similarity 0.7197 NPC104483
Intermediate Similarity 0.719 NPC101165
Intermediate Similarity 0.7188 NPC86288
Intermediate Similarity 0.7181 NPC27740
Intermediate Similarity 0.7171 NPC329896
Intermediate Similarity 0.7171 NPC475105
Intermediate Similarity 0.7171 NPC475090
Intermediate Similarity 0.716 NPC474561
Intermediate Similarity 0.716 NPC54988
Intermediate Similarity 0.716 NPC49954
Intermediate Similarity 0.716 NPC2272
Intermediate Similarity 0.7152 NPC230002
Intermediate Similarity 0.7143 NPC478184
Intermediate Similarity 0.7143 NPC243381
Intermediate Similarity 0.7143 NPC288838
Intermediate Similarity 0.7143 NPC143872
Intermediate Similarity 0.7143 NPC478182
Intermediate Similarity 0.7143 NPC275292
Intermediate Similarity 0.7134 NPC325903
Intermediate Similarity 0.7126 NPC131718
Intermediate Similarity 0.7124 NPC69914
Intermediate Similarity 0.7118 NPC63751
Intermediate Similarity 0.711 NPC150048
Intermediate Similarity 0.711 NPC203754
Intermediate Similarity 0.7108 NPC236711
Intermediate Similarity 0.7101 NPC2165
Intermediate Similarity 0.7083 NPC225018
Intermediate Similarity 0.7083 NPC478185
Intermediate Similarity 0.7078 NPC471322
Intermediate Similarity 0.7071 NPC76540
Intermediate Similarity 0.7071 NPC231655
Intermediate Similarity 0.7067 NPC122718
Intermediate Similarity 0.7066 NPC230869
Intermediate Similarity 0.7059 NPC476131
Intermediate Similarity 0.7059 NPC49217
Intermediate Similarity 0.7059 NPC56233
Intermediate Similarity 0.7059 NPC160105
Intermediate Similarity 0.7051 NPC198988
Intermediate Similarity 0.7048 NPC51054
Intermediate Similarity 0.7047 NPC329825
Intermediate Similarity 0.7041 NPC194640
Intermediate Similarity 0.7041 NPC247987
Intermediate Similarity 0.7041 NPC311276
Intermediate Similarity 0.7035 NPC470498
Intermediate Similarity 0.703 NPC138842
Intermediate Similarity 0.703 NPC200214
Intermediate Similarity 0.7012 NPC53947
Intermediate Similarity 0.7006 NPC325252
Remote Similarity 0.6989 NPC303820
Remote Similarity 0.6989 NPC23420
Remote Similarity 0.6989 NPC205254
Remote Similarity 0.6989 NPC106771
Remote Similarity 0.6977 NPC194411
Remote Similarity 0.6977 NPC473764
Remote Similarity 0.6977 NPC314940
Remote Similarity 0.6977 NPC91895
Remote Similarity 0.6977 NPC32534
Remote Similarity 0.6975 NPC470440
Remote Similarity 0.6971 NPC157583
Remote Similarity 0.697 NPC470233
Remote Similarity 0.6966 NPC110158
Remote Similarity 0.6964 NPC477591
Remote Similarity 0.6964 NPC56765
Remote Similarity 0.6962 NPC471312
Remote Similarity 0.6962 NPC65408
Remote Similarity 0.6961 NPC231536
Remote Similarity 0.6957 NPC20144
Remote Similarity 0.6952 NPC52909
Remote Similarity 0.6952 NPC94211
Remote Similarity 0.6952 NPC475935
Remote Similarity 0.6946 NPC476464
Remote Similarity 0.6944 NPC235843
Remote Similarity 0.6941 NPC102423
Remote Similarity 0.6941 NPC40779
Remote Similarity 0.6935 NPC237414
Remote Similarity 0.6932 NPC248462
Remote Similarity 0.6928 NPC278451
Remote Similarity 0.6928 NPC212125
Remote Similarity 0.6923 NPC470204
Remote Similarity 0.6923 NPC122141
Remote Similarity 0.6923 NPC215584
Remote Similarity 0.6923 NPC44773

Drug Structure

External Identifiers

TTD   DAP001035
DrugBank   DB01558
ChEMBL   CHEMBL277062
IUPHAR/BPS  
PharmaGKB   PA10035
KEGG Drug   D01245
PubChem CID   2441
ChEBI   31302
CAS Number  1812-30-2

Drug Properties

Molecular Weight  315.00
ALogP  0.4998
MLogP  2.45
XLogP  2.994
HDA  4
HBD  1
Rotatable Bonds  3
TPSA  57.84
RO5 Violation  0