COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK295042
Chemical Name: 2-chloro-N-{[4-(4-methoxy-2-nitrophenyl)piperazin-1-yl]carbonothioyl}-4-methylbenzamide
Smiles: COc1ccc(c(c1)[N+](=O)[O-])N1CCN(CC1)C(=S)NC(=O)c1ccc(cc1Cl)C

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Molecular Weight: 448.93
Empirical Formula: C20H21ClN4O4S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 3.664
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 122
Number of rings: 3

     

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