COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL099229
Chemical Name: 1-(3,4-dihydroxyphenyl)-2-{[4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl}ethanone
Smiles: CN1CCN(CC1)c1ccnc(n1)SCC(=O)c1ccc(c(c1)O)O

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Molecular Weight: 360.44
Empirical Formula: C17H20N4O3S

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 1.69
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 115
Number of rings: 3

     

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