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Ligand

NameCHEMBL245663
Molecular formulaC32H37N5O3
IUPAC nameN-[(2S)-1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-5-[1-(4-tert-butylphenyl)-5-pyridin-4-ylpyrazol-3-yl]pentanamide
Molecular weight539.68
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP5.0
SynonymsBDBM50206405
SCHEMBL4946412
(S)-N-(1-amino-3-(4-hydroxyphenyl)-1-oxopropan-2-yl)-5-(1-(4-tert-butylphenyl)-5-(pyridin-4-yl)-1H-pyrazol-3-yl)pentanamide
Inchi KeyKGBHHIGLNKFVHZ-NDEPHWFRSA-N
Inchi IDInChI=1S/C32H37N5O3/c1-32(2,3)24-10-12-26(13-11-24)37-29(23-16-18-34-19-17-23)21-25(36-37)6-4-5-7-30(39)35-28(31(33)40)20-22-8-14-27(38)15-9-22/h8-19,21,28,38H,4-7,20H2,1-3H3,(H2,33,40)(H,35,39)/t28-/m0/s1
PubChem CID44440784
ChEMBLCHEMBL245663
IUPHARN/A
BindingDB50206405
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
168320Lutropin-choriogonadotropic hormone receptorP22888LHCGRHomo sapiens (Human)699

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