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Ligand

NameCHEMBL1223177
Molecular formulaC24H21Cl2N7S
IUPAC name2-tert-butyl-5-[1-(2-chlorophenyl)-5-(4-chlorophenyl)-4-(1,2,4-triazol-1-ylmethyl)pyrazol-3-yl]-1,3,4-thiadiazole
Molecular weight510.441
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP6.3
SynonymsBDBM50325231
SCHEMBL923239
2-(4-((1h-1,2,4-triazol-1-yl)methyl)-1-(2-chlorophenyl)-5-(4-chlorophenyl)-1h-pyrazol-3-yl)-5-tert-butyl-1,3,4-thiadiazole
Inchi KeyAYVOANBRQFDRFL-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H21Cl2N7S/c1-24(2,3)23-30-29-22(34-23)20-17(12-32-14-27-13-28-32)21(15-8-10-16(25)11-9-15)33(31-20)19-7-5-4-6-18(19)26/h4-11,13-14H,12H2,1-3H3
PubChem CID49865308
ChEMBLCHEMBL1223177
IUPHARN/A
BindingDB50325231
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
17830Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473

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