COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK839542
Chemical Name: 2-{[(4-chloro-2,5-dimethoxyphenyl)amino]methylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: COc1cc(Cl)c(cc1NC=C1C(=O)CC(CC1=O)(C)C)OC

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Molecular Weight: 337.8
Empirical Formula: C17H20ClNO4

Physical State: Dry powder
Available Amount: 433 mg

Lipinsky:
logP: 2.99
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 2

     

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