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Ligand

NameCHEMBL423597
Molecular formulaC19H24N2O
IUPAC nameN-[(2-methoxyphenyl)methyl]-1-[methylamino(phenyl)methyl]cyclopropan-1-amine
Molecular weight296.414
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP2.7
SynonymsBDBM50097646
N-(2-Methoxybenzyl)-1-[alpha-(methylamino)benzyl]cyclopropane-1-amine
(2-Methoxy-benzyl)-[1-(methylamino-phenyl-methyl)-cyclopropyl]-amine
Inchi KeyAKWHRBSVVQXNOP-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H24N2O/c1-20-18(15-8-4-3-5-9-15)19(12-13-19)21-14-16-10-6-7-11-17(16)22-2/h3-11,18,20-21H,12-14H2,1-2H3
PubChem CID10085946
ChEMBLCHEMBL423597
IUPHARN/A
BindingDB50097646
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
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GLASS IDNameUniProtGeneSpeciesLength
7957Substance-P receptorP25103TACR1Homo sapiens (Human)407

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