COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016744
Chemical Name: (2E)-3-(2-butoxyphenyl)-2-cyano-N-{4-[(2,6-dimethylphenyl)sulfamoyl]phenyl}prop-2-enamide
Smiles: CCCCOc1ccccc1/C=C(/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1c(C)cccc1C)\C#N

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Molecular Weight: 503.62
Empirical Formula: C28H29N3O4S

Physical State: Dry powder
Available Amount: 327 mg

Lipinsky:
logP: 6.968
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 116
Number of rings: 3

     

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