COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK868425
Chemical Name: 5-(3,4-dimethoxyphenyl)-2-{[(3,5-dimethylphenyl)amino]methylidene}cyclohexane-1,3-dione
Smiles: COc1cc(ccc1OC)C1CC(=O)/C(=C/Nc2cc(C)cc(c2)C)/C(=O)C1

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Molecular Weight: 379.46
Empirical Formula: C23H25NO4

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 2.998
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 64
Number of rings: 3

     

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