COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL016992
Chemical Name: (2E)-3-(3-butoxyphenyl)-2-cyano-N-{5-[3-(trifluoromethyl)benzyl]-1,3-thiazol-2-yl}prop-2-enamide
Smiles: CCCCOc1cccc(c1)/C=C(/C(=O)Nc1ncc(s1)Cc1cccc(c1)C(F)(F)F)\C#N

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Molecular Weight: 485.53
Empirical Formula: C25H22F3N3O2S

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 6.705
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 103
Number of rings: 3

     

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