COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701730
Chemical Name: 2-{[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: Clc1ccc(cc1)c1nn(cc1C=C1C(=O)CC(CC1=O)(C)C)c1ccccc1

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Molecular Weight: 404.9
Empirical Formula: C24H21ClN2O2

Physical State: Dry powder
Available Amount: 502 mg

Lipinsky:
logP: 5.337
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 51
Number of rings: 4

     

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