COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK074816
Chemical Name: 3-[(4-bromo-2-chlorophenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Smiles: O=C1C=C(Nc2ccc(cc2Cl)Br)CC(C1)(C)C

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Molecular Weight: 328.64
Empirical Formula: C14H15BrClNO

Physical State: Dry powder
Available Amount: 215 mg

Lipinsky:
logP: 4.208
Rotatable bonds: 0
H-donors: 1
H-acceptors: 1
PSA: 29
Number of rings: 2

     

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