COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382195
Chemical Name: 5-[(1E)-2-cyano-3-({4-[(4-methylphenyl)sulfamoyl]phenyl}amino)-3-oxoprop-1-en-1-yl]-2-methoxyphenyl4-(acetylamino)benzenesulfonate
Smiles: N#C/C(=C\c1ccc(c(c1)OS(=O)(=O)c1ccc(cc1)NC(=O)C)OC)/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C

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Molecular Weight: 660.73
Empirical Formula: C32H28N4O8S2

Physical State: Dry powder
Available Amount: 95 mg

Lipinsky:
logP: 4.911
Rotatable bonds: 5
H-donors: 3
H-acceptors: 8
PSA: 197
Number of rings: 4

     

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