COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK339506
Chemical Name: 3-{[4-(1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperazin-1-yl)propan-1-one
Smiles: CN1CCN(CC1)C(=O)CCSc1nc(cc(n1)C(F)(F)F)c1ccc2c(c1)OCO2

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Molecular Weight: 454.47
Empirical Formula: C20H21F3N4O3S

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 3.86
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 93
Number of rings: 4

     

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