COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL062625
Chemical Name: N-({2-[(4-tert-butylphenyl)carbonyl]hydrazinyl}carbonothioyl)-4-chloro-3-nitrobenzamide
Smiles: S=C(NC(=O)c1ccc(c(c1)[N+](=O)[O-])Cl)NNC(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 434.9
Empirical Formula: C19H19ClN4O4S

Physical State: Dry powder
Available Amount: 174 mg

Lipinsky:
logP: 4.407
Rotatable bonds: 2
H-donors: 3
H-acceptors: 4
PSA: 148
Number of rings: 2

     

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