Drug Information

Drug ID:  NPD5907
Drug Name:  Olmesartan
Molecular Formula:  C24H26N6O3
Canonical SMILES:  CCCc1nc(c(n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1)C(=O)O)C(O)(C)C
Standard InCHI:  InChI=1S/C24H26N6O3/c1-4-7-19-25-21(24(2,3)33)20(23(31)32)30(19)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22-26-28-29-27-22/h5-6,8-13,33H,4,7,14H2,1-3H3,(H,31,32)(H,26,27,28,29)
Standard InCHIKey:  VTRAEEWXHOVJFV-UHFFFAOYSA-N
Max Developmental Stage:  Phase 3
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD5907

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 0.7018 NPC62995
Remote Similarity 0.6853 NPC74619
Remote Similarity 0.684 NPC267811
Remote Similarity 0.6807 NPC116622
Remote Similarity 0.6784 NPC116555
Remote Similarity 0.6757 NPC474916
Remote Similarity 0.6746 NPC63109
Remote Similarity 0.6667 NPC229893
Remote Similarity 0.6637 NPC57398
Remote Similarity 0.6636 NPC476341
Remote Similarity 0.6599 NPC171393
Remote Similarity 0.6599 NPC295452
Remote Similarity 0.6579 NPC472259
Remote Similarity 0.6573 NPC317054
Remote Similarity 0.6522 NPC243850
Remote Similarity 0.6498 NPC48317
Remote Similarity 0.6496 NPC282247
Remote Similarity 0.6475 NPC267078
Remote Similarity 0.6475 NPC935
Remote Similarity 0.6471 NPC272174
Remote Similarity 0.6461 NPC69843
Remote Similarity 0.645 NPC470786
Remote Similarity 0.645 NPC471155
Remote Similarity 0.6449 NPC474357
Remote Similarity 0.6447 NPC471944
Remote Similarity 0.6447 NPC54537
Remote Similarity 0.6444 NPC474896
Remote Similarity 0.6438 NPC285923
Remote Similarity 0.6434 NPC470323
Remote Similarity 0.6423 NPC263937
Remote Similarity 0.6423 NPC94428
Remote Similarity 0.6422 NPC270241
Remote Similarity 0.6422 NPC266249
Remote Similarity 0.6422 NPC71238
Remote Similarity 0.6417 NPC31097
Remote Similarity 0.6416 NPC141454
Remote Similarity 0.6415 NPC77101
Remote Similarity 0.6408 NPC328924
Remote Similarity 0.6407 NPC225400
Remote Similarity 0.6391 NPC295548
Remote Similarity 0.6391 NPC165599
Remote Similarity 0.6383 NPC471603
Remote Similarity 0.6379 NPC472538
Remote Similarity 0.6371 NPC147983
Remote Similarity 0.6371 NPC177996
Remote Similarity 0.6368 NPC123839
Remote Similarity 0.636 NPC250178
Remote Similarity 0.6343 NPC469938
Remote Similarity 0.634 NPC82370
Remote Similarity 0.634 NPC54981
Remote Similarity 0.6327 NPC280638
Remote Similarity 0.6303 NPC322064
Remote Similarity 0.63 NPC470787
Remote Similarity 0.63 NPC472540
Remote Similarity 0.63 NPC472539
Remote Similarity 0.629 NPC203635
Remote Similarity 0.6272 NPC472541
Remote Similarity 0.6272 NPC472542
Remote Similarity 0.6271 NPC242923
Remote Similarity 0.6261 NPC477979
Remote Similarity 0.625 NPC317701
Remote Similarity 0.6245 NPC323244
Remote Similarity 0.6244 NPC243058
Remote Similarity 0.6239 NPC244741
Remote Similarity 0.6225 NPC158055
Remote Similarity 0.6223 NPC132539
Remote Similarity 0.6222 NPC324091
Remote Similarity 0.6211 NPC326422
Remote Similarity 0.6208 NPC27041
Remote Similarity 0.6208 NPC312645
Remote Similarity 0.6204 NPC477633
Remote Similarity 0.6196 NPC477420
Remote Similarity 0.6196 NPC477418
Remote Similarity 0.6189 NPC130570
Remote Similarity 0.6179 NPC107160
Remote Similarity 0.6179 NPC187145
Remote Similarity 0.6176 NPC6865
Remote Similarity 0.6176 NPC471194
Remote Similarity 0.6176 NPC153980
Remote Similarity 0.6176 NPC471193
Remote Similarity 0.6172 NPC107836
Remote Similarity 0.6172 NPC469975
Remote Similarity 0.6169 NPC160666
Remote Similarity 0.6161 NPC90415
Remote Similarity 0.616 NPC182222
Remote Similarity 0.6157 NPC472116
Remote Similarity 0.6157 NPC102592
Remote Similarity 0.6157 NPC79356
Remote Similarity 0.6154 NPC473376
Remote Similarity 0.6154 NPC33949
Remote Similarity 0.6154 NPC156003
Remote Similarity 0.6151 NPC89508
Remote Similarity 0.6141 NPC472285
Remote Similarity 0.6141 NPC244425
Remote Similarity 0.6141 NPC15384
Remote Similarity 0.6141 NPC238945
Remote Similarity 0.6141 NPC471197
Remote Similarity 0.6134 NPC72956
Remote Similarity 0.6128 NPC471191
Remote Similarity 0.6126 NPC191415
Remote Similarity 0.6116 NPC248601
Remote Similarity 0.6116 NPC471198
Remote Similarity 0.6109 NPC110182
Remote Similarity 0.6106 NPC321708
Remote Similarity 0.6104 NPC212213
Remote Similarity 0.61 NPC471192
Remote Similarity 0.61 NPC36405
Remote Similarity 0.6098 NPC313884
Remote Similarity 0.6098 NPC98371
Remote Similarity 0.6084 NPC150447
Remote Similarity 0.6083 NPC31700
Remote Similarity 0.6081 NPC16659
Remote Similarity 0.608 NPC207686
Remote Similarity 0.6078 NPC81535
Remote Similarity 0.6074 NPC246658
Remote Similarity 0.6071 NPC207851
Remote Similarity 0.6066 NPC14686
Remote Similarity 0.6063 NPC219848
Remote Similarity 0.6062 NPC51854
Remote Similarity 0.605 NPC61038
Remote Similarity 0.6048 NPC476491
Remote Similarity 0.6047 NPC28945
Remote Similarity 0.6042 NPC118940
Remote Similarity 0.604 NPC21461
Remote Similarity 0.6037 NPC41717
Remote Similarity 0.6036 NPC265710
Remote Similarity 0.6036 NPC256268
Remote Similarity 0.6034 NPC102008
Remote Similarity 0.6032 NPC245756
Remote Similarity 0.6032 NPC471615
Remote Similarity 0.6027 NPC273532
Remote Similarity 0.6025 NPC269270
Remote Similarity 0.6023 NPC9729
Remote Similarity 0.6018 NPC141612
Remote Similarity 0.6018 NPC151635
Remote Similarity 0.6018 NPC135601
Remote Similarity 0.6018 NPC17273
Remote Similarity 0.6018 NPC94752
Remote Similarity 0.6017 NPC54744
Remote Similarity 0.6016 NPC39092
Remote Similarity 0.6016 NPC220851
Remote Similarity 0.6009 NPC91179
Remote Similarity 0.6009 NPC293917
Remote Similarity 0.6008 NPC285192
Remote Similarity 0.6 NPC470003
Remote Similarity 0.6 NPC322644
Remote Similarity 0.6 NPC21429
Remote Similarity 0.6 NPC472207
Remote Similarity 0.6 NPC471782
Remote Similarity 0.6 NPC471583
Remote Similarity 0.5992 NPC64216
Remote Similarity 0.5992 NPC220852
Remote Similarity 0.5991 NPC278434
Remote Similarity 0.5991 NPC284775
Remote Similarity 0.5991 NPC254762
Remote Similarity 0.5984 NPC285343
Remote Similarity 0.5984 NPC15801
Remote Similarity 0.5983 NPC476460
Remote Similarity 0.5982 NPC477891
Remote Similarity 0.5976 NPC260434
Remote Similarity 0.5976 NPC121069
Remote Similarity 0.5975 NPC473218
Remote Similarity 0.5975 NPC470702
Remote Similarity 0.5975 NPC75634
Remote Similarity 0.5973 NPC133003
Remote Similarity 0.5973 NPC241025
Remote Similarity 0.5966 NPC239954
Remote Similarity 0.5965 NPC221873
Remote Similarity 0.5965 NPC75544
Remote Similarity 0.5965 NPC472289
Remote Similarity 0.5961 NPC278540
Remote Similarity 0.596 NPC315822
Remote Similarity 0.5959 NPC308906
Remote Similarity 0.5956 NPC102755
Remote Similarity 0.5956 NPC159125
Remote Similarity 0.5955 NPC302647
Remote Similarity 0.5954 NPC471536
Remote Similarity 0.5952 NPC89987
Remote Similarity 0.5952 NPC114209
Remote Similarity 0.595 NPC470703
Remote Similarity 0.595 NPC207866
Remote Similarity 0.5949 NPC314648
Remote Similarity 0.5944 NPC2497
Remote Similarity 0.594 NPC106118
Remote Similarity 0.5939 NPC472031
Remote Similarity 0.5939 NPC472067
Remote Similarity 0.5939 NPC472066
Remote Similarity 0.5938 NPC24864
Remote Similarity 0.5938 NPC40530
Remote Similarity 0.5938 NPC314281
Remote Similarity 0.5935 NPC323969
Remote Similarity 0.5931 NPC198673
Remote Similarity 0.5928 NPC208060
Remote Similarity 0.5924 NPC175602
Remote Similarity 0.5923 NPC78767
Remote Similarity 0.5923 NPC473814
Remote Similarity 0.5921 NPC472323
Remote Similarity 0.5919 NPC240088
Remote Similarity 0.5919 NPC473380
Remote Similarity 0.5918 NPC473310

Drug Structure

External Identifiers

TTD   DAP001412
DrugBank   DB00275
ChEMBL   CHEMBL1516
IUPHAR/BPS  
PharmaGKB   PA164742950
KEGG Drug   D01204
PubChem CID  
ChEBI   48416
CAS Number  144689-24-7

Drug Properties

Molecular Weight  446.21
ALogP  -1.0263
MLogP  3.11
XLogP  6.703
HDA  9
HBD  3
Rotatable Bonds  13
TPSA  129.81
RO5 Violation  1