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Ligand

NameCHEMBL1773999
Molecular formulaC20H25ClN2O4S
IUPAC name(2S)-3-(4-chlorophenyl)-2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonylamino]-N-methylpropanamide
Molecular weight424.94
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP3.9
SynonymsBDBM50418385
Inchi KeyBOOJTNOOPUYIQF-KRWDZBQOSA-N
Inchi IDInChI=1S/C20H25ClN2O4S/c1-12-10-18(27-5)13(2)14(3)19(12)28(25,26)23-17(20(24)22-4)11-15-6-8-16(21)9-7-15/h6-10,17,23H,11H2,1-5H3,(H,22,24)/t17-/m0/s1
PubChem CID54583264
ChEMBLCHEMBL1773999
IUPHARN/A
BindingDB50418385
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
28980Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418

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