COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL482465
Chemical Name: 2-chloro-5-[(4Z)-4-{[1-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: CC1=NN(C(=O)/C/1=C\c1cnn(c1)c1ccc(c(c1)C)C)c1ccc(c(c1)C(=O)O)Cl

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Molecular Weight: 434.88
Empirical Formula: C23H19ClN4O3

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 3.951
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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