COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK701484
Chemical Name: 3,5-dinitro-N-{2,2,2-trichloro-1-[(3-nitrophenyl)amino]ethyl}benzamide
Smiles: O=C(c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-])NC(C(Cl)(Cl)Cl)Nc1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 478.63
Empirical Formula: C15H10Cl3N5O7

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 4.517
Rotatable bonds: 2
H-donors: 2
H-acceptors: 7
PSA: 178
Number of rings: 2

     

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