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Ligand

NameCHEMBL3799544
Molecular formulaC17H17N3O2
IUPAC name(3aR,4S,9bS)-8-nitro-4-phenyl-2,3,3a,4,5,9b-hexahydro-1H-pyrrolo[3,2-c]quinoline
Molecular weight295.342
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.8
SynonymsN/A
Inchi KeyKWPBMAJAQYJFDD-XKQJLSEDSA-N
Inchi IDInChI=1S/C17H17N3O2/c21-20(22)12-6-7-15-14(10-12)17-13(8-9-18-17)16(19-15)11-4-2-1-3-5-11/h1-7,10,13,16-19H,8-9H2/t13-,16+,17-/m0/s1
PubChem CID127047855
ChEMBLCHEMBL3799544
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
526616G-protein coupled estrogen receptor 1Q99527GPER1Homo sapiens (Human)375

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