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Ligand

NameCHEMBL1744061
Molecular formulaC14H17N3O3S
IUPAC name(2R)-2-acetamido-N-[(3-isothiocyanatophenyl)methyl]-3-methoxypropanamide
Molecular weight307.368
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP1.7
SynonymsN/A
Inchi KeyDDGQLFDRQVYNRX-CYBMUJFWSA-N
Inchi IDInChI=1S/C14H17N3O3S/c1-10(18)17-13(8-20-2)14(19)15-7-11-4-3-5-12(6-11)16-9-21/h3-6,13H,7-8H2,1-2H3,(H,15,19)(H,17,18)/t13-/m1/s1
PubChem CID11822955
ChEMBLCHEMBL1744061
IUPHARN/A
BindingDBN/A
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
57077Metabotropic glutamate receptor 1P23385Grm1Rattus norvegicus (Rat)1199

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