COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL432012
Chemical Name: (4Z)-2-(3-chlorophenyl)-4-{[1-(3-chlorophenyl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1cccc(c1)N1N=C(/C(=C/c2c(C)nn(c2O)c2cccc(c2)Cl)/C1=O)C

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Molecular Weight: 427.29
Empirical Formula: C21H16Cl2N4O2

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 5.548
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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