COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL327414
Chemical Name: N-[(4-nitrophenyl)carbamothioyl]-N'-[(phenylsulfonyl)methyl]benzenecarboximidamide
Smiles: S=C(N/C(=N/CS(=O)(=O)c1ccccc1)/c1ccccc1)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 454.53
Empirical Formula: C21H18N4O4S2

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.616
Rotatable bonds: 2
H-donors: 2
H-acceptors: 4
PSA: 156
Number of rings: 3

     

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