COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK632215
Chemical Name: methyl2-[({4-[5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}carbonothioyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=S)N1CCN(CC1)c1ccc(cn1)C(F)(F)F

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Molecular Weight: 424.45
Empirical Formula: C19H19F3N4O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.073
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 89
Number of rings: 3

     

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