COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK008194
Chemical Name: (2Z)-3-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-2-(4-nitrophenyl)prop-2-enenitrile
Smiles: COc1cc(ccc1c1ccc(o1)/C=C(/c1ccc(cc1)[N+](=O)[O-])\C#N)[N+](=O)[O-]

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Molecular Weight: 391.34
Empirical Formula: C20H13N3O6

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 5.259
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 137
Number of rings: 3

     

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