COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL313877
Chemical Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-4-(methylsulfanyl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)C1CCS(=O)(=O)C1)Nc1nc(C)cc(n1)C

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Molecular Weight: 441.62
Empirical Formula: C19H31N5O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.965
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 3

     

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