COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK952180
Chemical Name: 2-oxo-7-[3-(trifluoromethyl)phenyl]-1,3-benzoxathiol-5-yl(2E)-3-(4-chlorophenyl)prop-2-enoate
Smiles: O=C(Oc1cc2sc(=O)oc2c(c1)c1cccc(c1)C(F)(F)F)/C=C/c1ccc(cc1)Cl

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Molecular Weight: 476.86
Empirical Formula: C23H12ClF3O4S

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 7.439
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 77
Number of rings: 4

     

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