COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382193
Chemical Name: 2-[(1E)-2-cyano-3-({4-[(4-methylphenyl)sulfamoyl]phenyl}amino)-3-oxoprop-1-en-1-yl]-6-methoxyphenylbenzenesulfonate
Smiles: N#C/C(=C\c1cccc(c1OS(=O)(=O)c1ccccc1)OC)/C(=O)Nc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C

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Molecular Weight: 603.68
Empirical Formula: C30H25N3O7S2

Physical State: Dry powder
Available Amount: 207 mg

Lipinsky:
logP: 5.374
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 168
Number of rings: 4

     

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