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Ligand

NameCHEMBL3094114
Molecular formulaC21H25NO
IUPAC name3-(cyclopropylmethyl)-7-phenylmethoxy-1,2,4,5-tetrahydro-3-benzazepine
Molecular weight307.437
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.5
SynonymsAQRDKFVOYVDLCT-UHFFFAOYSA-N
3-(Cyclopropylmethyl)-7-[(phenylmethyl)oxy]-2,3,4,5-tetrahydro-1H-3-benzazepine
BDBM50443783
SCHEMBL4927686
Inchi KeyAQRDKFVOYVDLCT-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H25NO/c1-2-4-18(5-3-1)16-23-21-9-8-19-10-12-22(15-17-6-7-17)13-11-20(19)14-21/h1-5,8-9,14,17H,6-7,10-13,15-16H2
PubChem CID11709314
ChEMBLCHEMBL3094114
IUPHARN/A
BindingDB50443783
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12039Histamine H1 receptorP35367HRH1Homo sapiens (Human)487
12038Histamine H3 receptorQ9Y5N1HRH3Homo sapiens (Human)445

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