COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK344745
Chemical Name: N-({2-[4-(methylsulfonyl)piperazin-1-yl]phenyl}carbamothioyl)-2-(morpholin-4-yl)-5-nitrobenzamide
Smiles: S=C(NC(=O)c1cc(ccc1N1CCOCC1)[N+](=O)[O-])Nc1ccccc1N1CCN(CC1)S(=O)(=O)C

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Molecular Weight: 548.64
Empirical Formula: C23H28N6O6S2

Physical State: Dry powder
Available Amount: 151 mg

Lipinsky:
logP: 1.397
Rotatable bonds: 1
H-donors: 2
H-acceptors: 6
PSA: 180
Number of rings: 4

     

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