COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK947769
Chemical Name: (2E)-3-(5-bromo-2-methoxyphenyl)-N-{4-[4-(methylsulfonyl)piperazin-1-yl]phenyl}prop-2-enamide
Smiles: COc1ccc(cc1/C=C/C(=O)Nc1ccc(cc1)N1CCN(CC1)S(=O)(=O)C)Br

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Molecular Weight: 494.41
Empirical Formula: C21H24BrN3O4S

Physical State: Dry powder
Available Amount: 148 mg

Lipinsky:
logP: 3.641
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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