COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK220444
Chemical Name: (2E)-3-(3,5-dibromo-2-methoxyphenyl)-N-{4-[4-(methylsulfonyl)piperazin-1-yl]phenyl}prop-2-enamide
Smiles: COc1c(/C=C/C(=O)Nc2ccc(cc2)N2CCN(CC2)S(=O)(=O)C)cc(cc1Br)Br

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Molecular Weight: 573.31
Empirical Formula: C21H23Br2N3O4S

Physical State: Dry powder
Available Amount: 70 mg

Lipinsky:
logP: 4.227
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 87
Number of rings: 3

     

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