COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK068529
Chemical Name: 3-{[2-amino-5-(phenylcarbonyl)phenyl]amino}-5,5-dimethylcyclohex-2-en-1-one
Smiles: O=C1C=C(Nc2cc(ccc2N)C(=O)c2ccccc2)CC(C1)(C)C

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Molecular Weight: 334.42
Empirical Formula: C21H22N2O2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 3.465
Rotatable bonds: 1
H-donors: 3
H-acceptors: 2
PSA: 72
Number of rings: 3

     

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