COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051164
Chemical Name: (2E)-3-[(4-bromo-2-chlorophenyl)amino]-1-(4-methoxyphenyl)but-2-en-1-one
Smiles: COc1ccc(cc1)C(=O)/C=C(/Nc1ccc(cc1Cl)Br)\C

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Molecular Weight: 380.67
Empirical Formula: C17H15BrClNO2

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 5.257
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 38
Number of rings: 2

     

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