COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK412221
Chemical Name: N-{[3-chloro-2-(piperidin-1-yl)phenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1cccc(c1N1CCCCC1)Cl

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Molecular Weight: 462.96
Empirical Formula: C21H23ClN4O4S

Physical State: Dry powder
Available Amount: 283 mg

Lipinsky:
logP: 5.442
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 3

     

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