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Ligand

NameCHEMBL1086236
Molecular formulaC24H24ClN3O3S
IUPAC name4-[[(4-chlorophenyl)sulfonyl-(pyridin-2-ylmethyl)amino]methyl]-N-(cyclopropylmethyl)benzamide
Molecular weight469.984
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.7
Synonyms4-{[[(4-chlorophenyl)sulfonyl](pyridin-2-ylmethyl)amino]methyl}-N-(cyclopropylmethyl)benzamide
BDBM50320138
SCHEMBL1169737
4-((4-chloro-N-(pyridin-2-ylmethyl)phenylsulfonamido)methyl)-N-(cyclopropylmethyl)benzamide
ARXUIYQSARAZGV-UHFFFAOYSA-N
Inchi KeyARXUIYQSARAZGV-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H24ClN3O3S/c25-21-10-12-23(13-11-21)32(30,31)28(17-22-3-1-2-14-26-22)16-19-6-8-20(9-7-19)24(29)27-15-18-4-5-18/h1-3,6-14,18H,4-5,15-17H2,(H,27,29)
PubChem CID44253168
ChEMBLCHEMBL1086236
IUPHARN/A
BindingDB50320138
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
12860C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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