COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK670950
Chemical Name: [(3E)-3-{[1-(4-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-5-cyano-4-methyl-2,6-dioxo-3,6-dihydropyridin-1(2H)-yl]aceticacid
Smiles: N#CC1=C(C)/C(=C\c2c(C)nn(c2O)c2ccc(cc2)Cl)/C(=O)N(C1=O)CC(=O)O

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Molecular Weight: 426.82
Empirical Formula: C20H15ClN4O5

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.476
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 136
Number of rings: 3

     

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