COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL046528
Chemical Name: ethylN-[(4-{[(2E)-5-(ethylsulfanyl)-1,3,4-thiadiazol-2(3H)-ylidene]sulfamoyl}phenyl)carbamoyl]-3,3,3-trifluoro-2-(2,2,2-trifluoroethoxy)alaninate
Smiles: CCOC(=O)C(C(F)(F)F)(NC(=O)Nc1ccc(cc1)S(=O)(=O)/N=c/1\[nH]nc(s1)SCC)OCC(F)(F)F

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Molecular Weight: 611.57
Empirical Formula: C18H19F6N5O6S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.811
Rotatable bonds: 8
H-donors: 3
H-acceptors: 6
PSA: 206
Number of rings: 2

     

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