COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK253847
Chemical Name: N-[(2-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-4-ethoxy-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccccc1N1CCN(CC1)C(=O)c1ccc(cc1)Cl

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Molecular Weight: 568.05
Empirical Formula: C27H26ClN5O5S

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 3.472
Rotatable bonds: 3
H-donors: 2
H-acceptors: 5
PSA: 151
Number of rings: 4

     

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