COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK020496
Chemical Name: (2E)-3-(3,4-dimethoxyphenyl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
Smiles: COc1cc(/C=C/C(=O)Nc2nnc(s2)C(F)(F)F)ccc1OC

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Molecular Weight: 359.33
Empirical Formula: C14H12F3N3O3S

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 3.364
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 101
Number of rings: 2

     

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