COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL061405
Chemical Name: (2E)-N-{2-[(2-chloro-6-fluorobenzyl)sulfanyl]ethyl}-3-(3-nitrophenyl)-2-phenylprop-2-enamide
Smiles: O=C(/C(=C/c1cccc(c1)[N+](=O)[O-])/c1ccccc1)NCCSCc1c(F)cccc1Cl

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Molecular Weight: 470.95
Empirical Formula: C24H20ClFN2O3S

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 6.352
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 100
Number of rings: 3

     

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