COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK294988
Chemical Name: N-{[4-(2-chloro-6-nitrophenyl)piperazin-1-yl]carbonothioyl}-3,4-dimethoxybenzamide
Smiles: COc1ccc(cc1OC)C(=O)NC(=S)N1CCN(CC1)c1c(Cl)cccc1[N+](=O)[O-]

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Molecular Weight: 464.93
Empirical Formula: C20H21ClN4O5S

Physical State: Dry powder
Available Amount: 290 mg

Lipinsky:
logP: 4.209
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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