solifenacin   Click here for help

GtoPdb Ligand ID: 7483

Synonyms: Vesicare® | YM-67905 | YM-905
Approved drug
solifenacin is an approved drug (FDA (2004), UK (2009))
Compound class: Synthetic organic
Comment: The marketed formulation contains solifenacin succinate (PubChem CID 216457).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 32.78
Molecular weight 362.2
XLogP 3.57
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES O=C(N1CCc2c(C1c1ccccc1)cccc2)OC1CN2CCC1CC2
Isomeric SMILES O=C(N1CCc2c([C@@H]1c1ccccc1)cccc2)O[C@H]1CN2CCC1CC2
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
InChI Key FBOUYBDGKBSUES-VXKWHMMOSA-N
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (2004), UK (2009))
IUPAC Name Click here for help
[(8R)-1-azabicyclo[2.2.2]octan-8-yl] (1S)-1-phenyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
International Nonproprietary Names Click here for help
INN number INN
8155 solifenacin
Synonyms Click here for help
Vesicare® | YM-67905 | YM-905
Database Links Click here for help
CAS Registry No. 242478-37-1
ChEMBL Ligand CHEMBL1734
DrugBank Ligand DB01591
DrugCentral Ligand 2457
GtoPdb PubChem SID 187051786
PubChem CID 154059
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Wikipedia Solifenacin