COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL120981
Chemical Name: (2E)-N-{2-[(furan-2-ylmethyl)sulfanyl]ethyl}-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(/C=C/c1cccc(c1)[N+](=O)[O-])NCCSCc1ccco1

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Molecular Weight: 332.38
Empirical Formula: C16H16N2O4S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 3.145
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 2

     

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