COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK502035
Chemical Name: 2,2,3,3-tetrafluoropropyl6-(1,3-benzothiazol-2-ylcarbamoyl)cyclohex-3-ene-1-carboxylate
Smiles: O=C(C1CC=CCC1C(=O)Nc1nc2c(s1)cccc2)OCC(C(F)F)(F)F

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Molecular Weight: 416.4
Empirical Formula: C18H16F4N2O3S

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 4.258
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 96
Number of rings: 3

     

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