COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK863930
Chemical Name: N-{[4-(4-chloro-2-nitrophenyl)piperazin-1-yl]carbonothioyl}-3,4,5-trimethoxybenzamide
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)N1CCN(CC1)c1ccc(cc1[N+](=O)[O-])Cl

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Molecular Weight: 494.96
Empirical Formula: C21H23ClN4O6S

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 3.937
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 141
Number of rings: 3

     

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