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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	CHEMBL441252
Molecular formula	C32H39Cl4N5O4
IUPAC name	N-[(2Z,3R)-5-[4-[3-(2-amino-2-oxoethyl)-2-oxopiperidin-1-yl]piperidin-1-yl]-3-(3,4-dichlorophenyl)-2-methoxyiminopentyl]-3,5-dichloro-N-methylbenzamide
Molecular weight	699.495
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	5.6
Synonyms	BDBM50116076 N-[5-(3-Carbamoylmethyl-2-oxo-[1,4'']bipiperidinyl-1''-yl)-3-(3,4-dichloro-phenyl)-2-methoxyimino-pentyl]-3,5-dichloro-N-ethyl-benzamide
Inchi Key	AZJXZOMJEDHZHJ-PRHLXUIMSA-N
Inchi ID	InChI=1S/C32H39Cl4N5O4/c1-39(31(43)22-14-23(33)18-24(34)15-22)19-29(38-45-2)26(20-5-6-27(35)28(36)16-20)9-13-40-11-7-25(8-12-40)41-10-3-4-21(32(41)44)17-30(37)42/h5-6,14-16,18,21,25-26H,3-4,7-13,17,19H2,1-2H3,(H2,37,42)/b38-29+/t21?,26-/m1/s1
PubChem CID	44307677
ChEMBL	CHEMBL441252
IUPHAR	N/A
BindingDB	50116076
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
18251	Substance-K receptor	Q64077	TACR2	Cavia porcellus (Guinea pig)	402
18252	Substance-P receptor	P30547	TACR1	Cavia porcellus (Guinea pig)	407

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