COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383370
Chemical Name: (2E)-3-(2-butoxyphenyl)-2-cyano-N-(2-methyl-5-nitrophenyl)prop-2-enamide
Smiles: CCCCOc1ccccc1/C=C(/C(=O)Nc1cc(ccc1C)[N+](=O)[O-])\C#N

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Molecular Weight: 379.42
Empirical Formula: C21H21N3O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 5.831
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 2

     

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