COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL298306
Chemical Name: N-(2-{[(1E)-3-(3,4-dimethoxyphenyl)-3-oxoprop-1-en-1-yl]amino}phenyl)-4-nitrobenzenesulfonamide
Smiles: COc1ccc(cc1OC)C(=O)/C=C/Nc1ccccc1NS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 483.5
Empirical Formula: C23H21N3O7S

Physical State: Dry powder
Available Amount: 170 mg

Lipinsky:
logP: 4.063
Rotatable bonds: 4
H-donors: 2
H-acceptors: 7
PSA: 147
Number of rings: 3

     

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