COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK667076
Chemical Name: N-{2-[(2E)-2-{4-[(4-nitrobenzyl)oxy]benzylidene}hydrazinyl]-2-oxoethyl}-N-[3-(trifluoromethyl)phenyl]benzenesulfonamide(non-preferredname)
Smiles: O=C(CN(S(=O)(=O)c1ccccc1)c1cccc(c1)C(F)(F)F)N/N=C/c1ccc(cc1)OCc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 612.59
Empirical Formula: C29H23F3N4O6S

Physical State: Dry powder
Available Amount: 231 mg

Lipinsky:
logP: 6.501
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 142
Number of rings: 4

     

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