COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318768
Chemical Name: 1-(4-benzylpiperazin-1-yl)-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(methylsulfanyl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)Cc1ccccc1)Nc1nc(C)cc(n1)C

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Molecular Weight: 413.59
Empirical Formula: C22H31N5OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.616
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 86
Number of rings: 3

     

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