Drug Information

Drug ID:  NPD5579
Drug Name:  Solifenacin
Molecular Formula:  C23H26N2O2
Canonical SMILES:  O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2
Standard InCHI:  InChI=1S/C23H26N2O2/c26-23(27-21-16-24-13-10-18(21)11-14-24)25-15-12-17-6-4-5-9-20(17)22(25)19-7-2-1-3-8-19/h1-9,18,21-22H,10-16H2/t21-,22-/m0/s1
Standard InCHIKey:  FBOUYBDGKBSUES-VXKWHMMOSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  TTD; ChEMBL; IUPHAR/BPS

  Structural Similarity Between NPASS Natural Products and NPD5579

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
High Similarity 1.0 NPC314192
Intermediate Similarity 0.7368 NPC470926
Intermediate Similarity 0.7034 NPC329430
Remote Similarity 0.6967 NPC239854
Remote Similarity 0.6934 NPC105114
Remote Similarity 0.6934 NPC152850
Remote Similarity 0.6934 NPC89923
Remote Similarity 0.6934 NPC71933
Remote Similarity 0.6934 NPC239990
Remote Similarity 0.6861 NPC136453
Remote Similarity 0.68 NPC473418
Remote Similarity 0.6786 NPC157311
Remote Similarity 0.6744 NPC269340
Remote Similarity 0.6738 NPC44805
Remote Similarity 0.6738 NPC8761
Remote Similarity 0.6667 NPC104070
Remote Similarity 0.6667 NPC478140
Remote Similarity 0.6589 NPC292758
Remote Similarity 0.6589 NPC65855
Remote Similarity 0.6535 NPC474695
Remote Similarity 0.6525 NPC40488
Remote Similarity 0.6496 NPC475915
Remote Similarity 0.6466 NPC246904
Remote Similarity 0.6463 NPC239762
Remote Similarity 0.6463 NPC163392
Remote Similarity 0.6456 NPC73644
Remote Similarity 0.6441 NPC305602
Remote Similarity 0.6441 NPC17497
Remote Similarity 0.6429 NPC79698
Remote Similarity 0.6423 NPC316582
Remote Similarity 0.6423 NPC326232
Remote Similarity 0.6414 NPC313352
Remote Similarity 0.6406 NPC167336
Remote Similarity 0.6395 NPC77992
Remote Similarity 0.6393 NPC474974
Remote Similarity 0.6376 NPC161069
Remote Similarity 0.637 NPC470544
Remote Similarity 0.6357 NPC307020
Remote Similarity 0.6356 NPC258046
Remote Similarity 0.6336 NPC158854
Remote Similarity 0.6331 NPC84281
Remote Similarity 0.6331 NPC291027
Remote Similarity 0.6331 NPC169485
Remote Similarity 0.6331 NPC213126
Remote Similarity 0.6331 NPC317474
Remote Similarity 0.6329 NPC187022
Remote Similarity 0.6329 NPC80129
Remote Similarity 0.6327 NPC127741
Remote Similarity 0.6324 NPC470545
Remote Similarity 0.6299 NPC291610
Remote Similarity 0.6296 NPC473573
Remote Similarity 0.6296 NPC101139
Remote Similarity 0.6279 NPC476198
Remote Similarity 0.6277 NPC228515
Remote Similarity 0.6277 NPC470546
Remote Similarity 0.6276 NPC473962
Remote Similarity 0.6267 NPC22082
Remote Similarity 0.6267 NPC186284
Remote Similarity 0.626 NPC322040
Remote Similarity 0.6258 NPC7467
Remote Similarity 0.625 NPC128019
Remote Similarity 0.625 NPC69496
Remote Similarity 0.625 NPC476567
Remote Similarity 0.625 NPC136860
Remote Similarity 0.6233 NPC233910
Remote Similarity 0.6233 NPC245836
Remote Similarity 0.622 NPC316797
Remote Similarity 0.6214 NPC252878
Remote Similarity 0.6212 NPC24777
Remote Similarity 0.6209 NPC116519
Remote Similarity 0.6209 NPC138775
Remote Similarity 0.6207 NPC126458
Remote Similarity 0.6196 NPC472114
Remote Similarity 0.6196 NPC472115
Remote Similarity 0.6194 NPC16107
Remote Similarity 0.6194 NPC144863
Remote Similarity 0.6194 NPC106295
Remote Similarity 0.6194 NPC51957
Remote Similarity 0.6194 NPC476144
Remote Similarity 0.6194 NPC210437
Remote Similarity 0.619 NPC322598
Remote Similarity 0.6187 NPC45777
Remote Similarity 0.6187 NPC477061
Remote Similarity 0.6186 NPC169016
Remote Similarity 0.6184 NPC209509
Remote Similarity 0.6176 NPC256288
Remote Similarity 0.6176 NPC220961
Remote Similarity 0.617 NPC46427
Remote Similarity 0.6169 NPC472100
Remote Similarity 0.6168 NPC475427
Remote Similarity 0.6164 NPC246079
Remote Similarity 0.6159 NPC220698
Remote Similarity 0.6159 NPC169743
Remote Similarity 0.6159 NPC314682
Remote Similarity 0.6154 NPC252794
Remote Similarity 0.6149 NPC474787
Remote Similarity 0.6149 NPC151706
Remote Similarity 0.6149 NPC76785
Remote Similarity 0.6149 NPC474855
Remote Similarity 0.6149 NPC476102
Remote Similarity 0.6149 NPC9687
Remote Similarity 0.6149 NPC475598
Remote Similarity 0.6149 NPC273907
Remote Similarity 0.6149 NPC49577
Remote Similarity 0.6149 NPC475318
Remote Similarity 0.6149 NPC293377
Remote Similarity 0.6149 NPC118099
Remote Similarity 0.6149 NPC79465
Remote Similarity 0.6149 NPC260045
Remote Similarity 0.6149 NPC474811
Remote Similarity 0.6149 NPC90194
Remote Similarity 0.6144 NPC262077
Remote Similarity 0.6143 NPC71684
Remote Similarity 0.614 NPC2933
Remote Similarity 0.6139 NPC478076
Remote Similarity 0.6135 NPC472106
Remote Similarity 0.6125 NPC113946
Remote Similarity 0.6122 NPC313663
Remote Similarity 0.6118 NPC213206
Remote Similarity 0.6118 NPC188163
Remote Similarity 0.6118 NPC328750
Remote Similarity 0.6118 NPC475128
Remote Similarity 0.6118 NPC474915
Remote Similarity 0.6115 NPC92541
Remote Similarity 0.6115 NPC473341
Remote Similarity 0.6115 NPC122590
Remote Similarity 0.6111 NPC472120
Remote Similarity 0.6111 NPC472101
Remote Similarity 0.6111 NPC311242
Remote Similarity 0.6107 NPC471265
Remote Similarity 0.6107 NPC68865
Remote Similarity 0.6107 NPC471264
Remote Similarity 0.6105 NPC259626
Remote Similarity 0.6105 NPC476095
Remote Similarity 0.6103 NPC33742
Remote Similarity 0.6102 NPC119677
Remote Similarity 0.6094 NPC228400
Remote Similarity 0.6094 NPC214200
Remote Similarity 0.6094 NPC474582
Remote Similarity 0.6093 NPC263493
Remote Similarity 0.6093 NPC269398
Remote Similarity 0.609 NPC109787
Remote Similarity 0.6087 NPC471527
Remote Similarity 0.6087 NPC146288
Remote Similarity 0.6087 NPC469461
Remote Similarity 0.6087 NPC247639
Remote Similarity 0.6087 NPC25084
Remote Similarity 0.6084 NPC474847
Remote Similarity 0.6071 NPC476990
Remote Similarity 0.6069 NPC469666
Remote Similarity 0.6069 NPC473615
Remote Similarity 0.6067 NPC178662
Remote Similarity 0.6067 NPC470884
Remote Similarity 0.6067 NPC98424
Remote Similarity 0.6067 NPC92784
Remote Similarity 0.6067 NPC476133
Remote Similarity 0.6065 NPC105717
Remote Similarity 0.6062 NPC29285
Remote Similarity 0.6061 NPC284183
Remote Similarity 0.6061 NPC4138
Remote Similarity 0.6061 NPC121275
Remote Similarity 0.6061 NPC469462
Remote Similarity 0.6056 NPC474082
Remote Similarity 0.6056 NPC175726
Remote Similarity 0.6054 NPC325479
Remote Similarity 0.6054 NPC246913
Remote Similarity 0.6053 NPC139326
Remote Similarity 0.6053 NPC271642
Remote Similarity 0.6048 NPC476425
Remote Similarity 0.6048 NPC473743
Remote Similarity 0.6048 NPC214626
Remote Similarity 0.6048 NPC251212
Remote Similarity 0.6048 NPC139085
Remote Similarity 0.6048 NPC473661
Remote Similarity 0.6043 NPC310467
Remote Similarity 0.6037 NPC475420
Remote Similarity 0.6034 NPC229484
Remote Similarity 0.6029 NPC35850
Remote Similarity 0.6029 NPC276949
Remote Similarity 0.6028 NPC202521
Remote Similarity 0.6027 NPC179224
Remote Similarity 0.6026 NPC212799
Remote Similarity 0.6026 NPC307357
Remote Similarity 0.6026 NPC46098
Remote Similarity 0.6026 NPC268841
Remote Similarity 0.6025 NPC138487
Remote Similarity 0.6025 NPC216459
Remote Similarity 0.6025 NPC41178
Remote Similarity 0.6014 NPC285394
Remote Similarity 0.6013 NPC243756
Remote Similarity 0.6013 NPC52748
Remote Similarity 0.6013 NPC476978
Remote Similarity 0.6013 NPC470925
Remote Similarity 0.6012 NPC471052
Remote Similarity 0.6012 NPC216816
Remote Similarity 0.6012 NPC471051
Remote Similarity 0.6012 NPC471053
Remote Similarity 0.6012 NPC85651
Remote Similarity 0.6 NPC210148
Remote Similarity 0.6 NPC292675

Drug Structure

External Identifiers

TTD   DAP001129
DrugBank   DB01591
ChEMBL   CHEMBL1734
IUPHAR/BPS   7483
PharmaGKB   PA164783810
KEGG Drug   D08522
PubChem CID   154059
ChEBI   135530
CAS Number  242478-37-1

Drug Properties

Molecular Weight  362.20
ALogP  -0.7517
MLogP  3.55
XLogP  6.131
HDA  4
HBD  0
Rotatable Bonds  4
TPSA  32.78
RO5 Violation  1