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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL598095
Molecular formula	C25H23Cl3N6O2
IUPAC name	5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-[(1S,2S)-2-hydroxycyclohexyl]-4-(1,2,4-triazol-1-ylmethyl)pyrazole-3-carboxamide
Molecular weight	545.849
Hydrogen bond acceptor	5
Hydrogen bond donor	2
XlogP	5.4
Synonyms	BDBM50310041 4-((1H-1,2,4-Triazol-1-yl)methyl)-5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-N-((1S,2S)-2-hydroxycyclohexyl)-1Hpyrazole-3-carboxamide
Inchi Key	AEMUPACUOBYQEJ-UNMCSNQZSA-N
Inchi ID	InChI=1S/C25H23Cl3N6O2/c26-16-7-5-15(6-8-16)24-18(12-33-14-29-13-30-33)23(25(36)31-20-3-1-2-4-22(20)35)32-34(24)21-10-9-17(27)11-19(21)28/h5-11,13-14,20,22,35H,1-4,12H2,(H,31,36)/t20-,22-/m0/s1
PubChem CID	46231339
ChEMBL	CHEMBL598095
IUPHAR	N/A
BindingDB	50310041
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
3647	Cannabinoid receptor 1	P20272	Cnr1	Rattus norvegicus (Rat)	473

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