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Ligand

NameCHEMBL1802283
Molecular formulaC18H18N4
IUPAC nameN-[[4-(anilinomethyl)phenyl]methyl]pyrimidin-2-amine
Molecular weight290.37
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.5
SynonymsUS9205085, MSX- 195
BDBM194519
SCHEMBL10055016
Inchi KeyCSOMGVRYWMTYFA-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18N4/c1-2-5-17(6-3-1)21-13-15-7-9-16(10-8-15)14-22-18-19-11-4-12-20-18/h1-12,21H,13-14H2,(H,19,20,22)
PubChem CID49857287
ChEMBLCHEMBL1802283
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
49607C-X-C chemokine receptor type 4P61073CXCR4Homo sapiens (Human)352

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