COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK603127
Chemical Name: (2E)-2-[(4-methoxyphenyl)sulfonyl]-3-(4-phenylpiperazin-1-yl)prop-2-enenitrile
Smiles: COc1ccc(cc1)S(=O)(=O)/C(=C/N1CCN(CC1)c1ccccc1)/C#N

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Molecular Weight: 383.47
Empirical Formula: C20H21N3O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.759
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 82
Number of rings: 3

     

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