COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448108
Chemical Name: methyl{5-amino-6-cyano-8-(methylcarbamoyl)-3-oxo-7-[4-(trifluoromethyl)phenyl]-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridin-2-yl}acetate
Smiles: CNC(=O)C1=C2SC(C(=O)N2C(=C(C1c1ccc(cc1)C(F)(F)F)C#N)N)CC(=O)OC

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Molecular Weight: 466.44
Empirical Formula: C20H17F3N4O4S

Physical State: Dry powder
Available Amount: 47 mg

Lipinsky:
logP: 2.236
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 150
Number of rings: 3

     

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