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Ligand

NameCHEMBL2430978
Molecular formulaC23H24FN7OS
IUPAC name(2S)-3-(4-fluorophenyl)-N-[2-methyl-5-[2-(methylamino)pyridin-4-yl]pyrazol-3-yl]-2-(1,3-thiazol-5-ylmethylamino)propanamide
Molecular weight465.551
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogP2.9
SynonymsBDBM50440712
Inchi KeyNTBCOAPAWGPOOY-FQEVSTJZSA-N
Inchi IDInChI=1S/C23H24FN7OS/c1-25-21-10-16(7-8-27-21)19-11-22(31(2)30-19)29-23(32)20(28-13-18-12-26-14-33-18)9-15-3-5-17(24)6-4-15/h3-8,10-12,14,20,28H,9,13H2,1-2H3,(H,25,27)(H,29,32)/t20-/m0/s1
PubChem CID73353863
ChEMBLCHEMBL2430978
IUPHARN/A
BindingDB50440712
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
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GLASS IDNameUniProtGeneSpeciesLength
231321Probable G-protein coupled receptor 142Q7Z601GPR142Homo sapiens (Human)462

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