COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210654
Chemical Name: 2-({[4-(4-chlorophenyl)-3-methyl-1H-pyrazol-5-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
Smiles: Clc1ccc(cc1)c1c(NC=C2C(=O)CC(CC2=O)(C)C)[nH]nc1C

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Molecular Weight: 357.84
Empirical Formula: C19H20ClN3O2

Physical State: Dry powder
Available Amount: 351 mg

Lipinsky:
logP: 3.371
Rotatable bonds: 0
H-donors: 2
H-acceptors: 2
PSA: 74
Number of rings: 3

     

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