COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK183522
Chemical Name: ethyl4-(4-acetylpiperazin-1-yl)-3-{[(2-chloro-4-nitrophenyl)carbonyl]amino}benzoate
Smiles: CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)[N+](=O)[O-])N1CCN(CC1)C(=O)C

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Molecular Weight: 474.9
Empirical Formula: C22H23ClN4O6

Physical State: Dry powder
Available Amount: 159 mg

Lipinsky:
logP: 2.518
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 124
Number of rings: 3

     

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