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Ligand

NameCHEMBL1907653
Molecular formulaC32H42ClN7O4S
IUPAC name(2S)-1-[4-[2-(benzhydrylcarbamoyl)hydrazinyl]-3-chlorophenyl]sulfonyl-N-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]pyrrolidine-2-carboxamide
Molecular weight656.243
Hydrogen bond acceptor8
Hydrogen bond donor4
XlogP4.2
SynonymsBDBM50370078
Inchi KeyJCXZWRRTUALXAQ-LJAQVGFWSA-N
Inchi IDInChI=1S/C32H42ClN7O4S/c1-38(2)21-22-39(3)20-18-34-31(41)29-15-10-19-40(29)45(43,44)26-16-17-28(27(33)23-26)36-37-32(42)35-30(24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4-9,11-14,16-17,23,29-30,36H,10,15,18-22H2,1-3H3,(H,34,41)(H2,35,37,42)/t29-/m0/s1
PubChem CID10886849
ChEMBLCHEMBL1907653
IUPHARN/A
BindingDB50370078
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
147851B2 bradykinin receptorP25023Bdkrb2Rattus norvegicus (Rat)396

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