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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	CHEMBL310416
Molecular formula	C27H22ClN3O2
IUPAC name	N-[3-chloro-4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl)phenyl]-2-methylbenzamide
Molecular weight	455.942
Hydrogen bond acceptor	2
Hydrogen bond donor	1
XlogP	4.7
Synonyms	N-[4-(5H,11H-Benzo[e]pyrrolo[1,2-a][1,4]diazepine-10-carbonyl)-3-chloro-phenyl]-2-methyl-benzamide N-[4-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-3-chlorophenyl]-2-methylbenzamide N-[4-(5H-pyrrolo-[2,1-c][1,4]benzodiazepin-10(11H)-ylcarbonyl)-3-chlorophenyl]-2-methylbenzamide BDBM50065121 SCHEMBL7339573 FEBJVBOYUNFEAD-UHFFFAOYSA-N N-[4-(5H-pyrrolo[2,1-c][1,4]benzodiazepin-10 (11H) -ylcarbonyl) -3-chlorophenyl]-2-methylbenzamide [ Show all ]
Inchi Key	FEBJVBOYUNFEAD-UHFFFAOYSA-N
Inchi ID	InChI=1S/C27H22ClN3O2/c1-18-7-2-4-10-22(18)26(32)29-20-12-13-23(24(28)15-20)27(33)31-17-21-9-6-14-30(21)16-19-8-3-5-11-25(19)31/h2-15H,16-17H2,1H3,(H,29,32)
PubChem CID	10742418
ChEMBL	CHEMBL310416
IUPHAR	N/A
BindingDB	50065121
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

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
76086	Vasopressin V1a receptor	P30560	Avpr1a	Rattus norvegicus (Rat)	424
76088	Vasopressin V1a receptor	P37288	AVPR1A	Homo sapiens (Human)	418
76085	Vasopressin V2 receptor	P30518	AVPR2	Homo sapiens (Human)	371
76087	Vasopressin V2 receptor	Q00788	Avpr2	Rattus norvegicus (Rat)	371

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