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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	CHEMBL385399
Molecular formula	C29H31F3N6O3
IUPAC name	N-[(3R)-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-3H-1,4-benzodiazepin-3-yl]-4-(2-oxo-5-propan-2-yl-1H-imidazol-3-yl)piperidine-1-carboxamide
Molecular weight	568.601
Hydrogen bond acceptor	7
Hydrogen bond donor	2
XlogP	4.0
Synonyms	(R)-4-(4-isopropyl-2-oxo-2,3-dihydroimidazol-1-yl)-N-(2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)piperidine-1-carboxamide ACRITJBLUVYWQP-VWLOTQADSA-N 4-(4-Isopropyl-2-oxo-2,3-dihydro-1H-imidazol-1-yl)-N-[(3R)-2-oxo-5-phenyl-1-(2,2,2-trifluoroethyl)-2,3-dihydro-1H-1,4-benzodiazepin-3-yl]piperidine-1-carboxamide BDBM50192567 SCHEMBL3248220
Inchi Key	ACRITJBLUVYWQP-VWLOTQADSA-N
Inchi ID	InChI=1S/C29H31F3N6O3/c1-18(2)22-16-37(28(41)33-22)20-12-14-36(15-13-20)27(40)35-25-26(39)38(17-29(30,31)32)23-11-7-6-10-21(23)24(34-25)19-8-4-3-5-9-19/h3-11,16,18,20,25H,12-15,17H2,1-2H3,(H,33,41)(H,35,40)/t25-/m0/s1
PubChem CID	11570464
ChEMBL	CHEMBL385399
IUPHAR	N/A
BindingDB	50192567
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
1828	Calcitonin gene-related peptide type 1 receptor	Q16602	CALCRL	Homo sapiens (Human)	461

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