COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL121017
Chemical Name: (2E)-N-{2-methyl-4-[(phenylsulfanyl)methyl]phenyl}-3-(3-nitrophenyl)prop-2-enamide
Smiles: O=C(Nc1ccc(cc1C)CSc1ccccc1)/C=C/c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 404.49
Empirical Formula: C23H20N2O3S

Physical State: Dry powder
Available Amount: 71 mg

Lipinsky:
logP: 5.671
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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