COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK212770
Chemical Name: ethyl4-[({4-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperazin-1-yl}carbonothioyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)N1CCN(CC1)c1nc(C)nc(c1)C(F)(F)F

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Molecular Weight: 453.49
Empirical Formula: C20H22F3N5O2S

Physical State: Dry powder
Available Amount: 92 mg

Lipinsky:
logP: 2.637
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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