COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201690
Chemical Name: 4-[(4E)-4-{[3,5-dimethyl-1-(4-methylphenyl)-1H-pyrazol-4-yl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: Cc1ccc(cc1)n1nc(c(c1C)/C=C/1\C(=NN(C1=O)c1ccc(cc1)C(=O)O)C)C

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Molecular Weight: 414.46
Empirical Formula: C24H22N4O3

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 4.267
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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