COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK345631
Chemical Name: N-{[3-chloro-4-(4-ethylpiperazin-1-yl)phenyl]carbamothioyl}-4-ethoxy-3-nitrobenzamide
Smiles: CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(c(c1)Cl)N1CCN(CC1)CC

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Molecular Weight: 492
Empirical Formula: C22H26ClN5O4S

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.795
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 134
Number of rings: 3

     

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