COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK003007
Chemical Name: ethyl4-[({4-hydroxy-4-[3-(trifluoromethyl)phenyl]piperidin-1-yl}carbonothioyl)amino]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=S)N1CCC(CC1)(O)c1cccc(c1)C(F)(F)F

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Molecular Weight: 452.5
Empirical Formula: C22H23F3N2O3S

Physical State: Dry powder
Available Amount: 629 mg

Lipinsky:
logP: 3.893
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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