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Ligand

NameBDBM50295224
Molecular formulaC21H20ClFN2O
IUPAC name6-(2-chloro-6-fluorophenyl)-3,9-dimethyl-5,6,6a,8,9,10-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Molecular weight370.852
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.5
Synonyms11-(2-chloro-6-fluorophenyl)-3,8-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Inchi KeyFMSPMCATPJWWEM-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H20ClFN2O/c1-11-6-7-15-16(8-11)25-21(19-13(22)4-3-5-14(19)23)20-17(24-15)9-12(2)10-18(20)26/h3-8,12,20-21,25H,9-10H2,1-2H3
PubChem CID91934295
ChEMBLN/A
IUPHARN/A
BindingDB50295224
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
82232Neuromedin-B receptorP28336NMBRHomo sapiens (Human)390

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