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Ligand

NameCHEMBL496014
Molecular formulaC24H23N5
IUPAC name1-benzyl-4-(4-pyridin-2-ylpiperazin-1-yl)phthalazine
Molecular weight381.483
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.4
SynonymsMCULE-5522855166
ZINC16480912
1-Benzyl-4-(4-pyridin-2-yl-piperazin-1-yl)phthalazine
SCHEMBL3602651
AKOS024351099
[ Show all ]
Inchi KeyFCTUWPXBMWNCFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H23N5/c1-2-8-19(9-3-1)18-22-20-10-4-5-11-21(20)24(27-26-22)29-16-14-28(15-17-29)23-12-6-7-13-25-23/h1-13H,14-18H2
PubChem CID18526613
ChEMBLCHEMBL496014
IUPHARN/A
BindingDB50269041
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
75231Smoothened homologP56726SmoMus musculus (Mouse)793
75232Smoothened homologQ99835SMOHomo sapiens (Human)787

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