COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL440412
Chemical Name: methyl(2Z)-[5-amino-6-cyano-7-(3-fluorophenyl)-8-(methylcarbamoyl)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Smiles: CNC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1cccc(c1)F)C#N)N

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Saltdata: HCl
Molecular Weight: 414.42
Empirical Formula: C19H15FN4O4S

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: 1.468
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 150
Number of rings: 3

     

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