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Ligand

NameCHEMBL3734010
Molecular formulaC25H21F4N5O3
IUPAC name3-fluoro-4-[3-methoxy-4-oxo-2-[[(1S)-1-[4-(trifluoromethyl)phenyl]ethyl]amino]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carbonyl]benzonitrile
Molecular weight515.469
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP2.9
SynonymsBDBM195623
SCHEMBL10285865
US9206173, 11
Inchi KeyIUPZDWCKTBBVGT-AWEZNQCLSA-N
Inchi IDInChI=1S/C25H21F4N5O3/c1-14(16-4-6-17(7-5-16)25(27,28)29)31-24-32-21-9-10-33(13-19(21)23(36)34(24)37-2)22(35)18-8-3-15(12-30)11-20(18)26/h3-8,11,14H,9-10,13H2,1-2H3,(H,31,32)/t14-/m0/s1
PubChem CID49787185
ChEMBLCHEMBL3734010
IUPHARN/A
BindingDB195623
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
539614Prolactin-releasing peptide receptorP49683PRLHRHomo sapiens (Human)370

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