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Ligand

NameCHEMBL402218
Molecular formulaC24H28FN5
IUPAC name2-cyclopropyl-N-[1-[4-(4-fluorophenyl)piperazin-1-yl]propan-2-yl]quinazolin-4-amine
Molecular weight405.521
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.6
SynonymsBDBM50373819
Inchi KeyHRIXKFGKXWVPNS-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H28FN5/c1-17(16-29-12-14-30(15-13-29)20-10-8-19(25)9-11-20)26-24-21-4-2-3-5-22(21)27-23(28-24)18-6-7-18/h2-5,8-11,17-18H,6-7,12-16H2,1H3,(H,26,27,28)
PubChem CID44454370
ChEMBLCHEMBL402218
IUPHARN/A
BindingDB50373819
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
122120Lysophosphatidic acid receptor 2Q9HBW0LPAR2Homo sapiens (Human)351

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