COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393094
Chemical Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-N-(2-{(2E)-2-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylidene]hydrazinyl}-2-oxoethyl)methanesulfonamide(non-preferredname)
Smiles: O=C(CN(S(=O)(=O)C)c1ccc(c(c1)C(F)(F)F)Cl)N/N=C(/c1ccc2c(c1)OCCO2)\C

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Molecular Weight: 505.9
Empirical Formula: C20H19ClF3N3O5S

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 4.455
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 105
Number of rings: 3

     

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