COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL382789
Chemical Name: (2E)-N-(2-chloro-4-nitrophenyl)-2-cyano-3-[4-(2-cyano-4-nitrophenoxy)phenyl]prop-2-enamide
Smiles: N#C/C(=C\c1ccc(cc1)Oc1ccc(cc1C#N)[N+](=O)[O-])/C(=O)Nc1ccc(cc1Cl)[N+](=O)[O-]

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Molecular Weight: 489.83
Empirical Formula: C23H12ClN5O6

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 5.676
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 177
Number of rings: 3

     

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