COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK202200
Chemical Name: 2-chloro-N-(2-{4-[(2-chloro-4-nitrophenyl)carbonyl]piperazin-1-yl}ethyl)-4-nitrobenzamide
Smiles: O=C(c1ccc(cc1Cl)[N+](=O)[O-])NCCN1CCN(CC1)C(=O)c1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 496.31
Empirical Formula: C20H19Cl2N5O6

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 2.348
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 144
Number of rings: 3

     

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