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Ligand

NameCHEMBL3828236
Molecular formulaC29H35N3
IUPAC nameN-benzyl-N-[[6-[[benzyl(cyclopropylmethyl)amino]methyl]pyridin-3-yl]methyl]-1-cyclopropylmethanamine
Molecular weight425.62
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP5.0
SynonymsN/A
Inchi KeyCJOMWPDGJAURLE-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H35N3/c1-3-7-24(8-4-1)18-31(20-26-11-12-26)22-28-15-16-29(30-17-28)23-32(21-27-13-14-27)19-25-9-5-2-6-10-25/h1-10,15-17,26-27H,11-14,18-23H2
PubChem CID127045277
ChEMBLCHEMBL3828236
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
522800C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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