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Ligand

NameCID 45273323
Molecular formulaC20H18ClFN2O
IUPAC name6-(2-chloro-6-fluorophenyl)-3-methyl-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Molecular weight356.825
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.5
SynonymsN/A
Inchi KeyFVLQKDWADPKZFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18ClFN2O/c1-11-8-9-14-16(10-11)24-20(18-12(21)4-2-5-13(18)22)19-15(23-14)6-3-7-17(19)25/h2,4-5,8-10,20,23-24H,3,6-7H2,1H3
PubChem CID45273323
ChEMBLCHEMBL556898
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
88279Neuromedin-B receptorP28336NMBRHomo sapiens (Human)390

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