COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK255177
Chemical Name: N-{[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Smiles: CCCC(=O)N1CCN(CC1)c1ccc(cc1Cl)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])OCC

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Molecular Weight: 534.04
Empirical Formula: C24H28ClN5O5S

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 4.453
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 151
Number of rings: 3

     

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