COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK519491
Chemical Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-{[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethanone
Smiles: O=C(N1CCN(CC1)Cc1ccc2c(c1)OCO2)CSc1nc(cc(n1)C(F)(F)F)c1ccccc1

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Molecular Weight: 516.54
Empirical Formula: C25H23F3N4O3S

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.23
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 5

     

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