COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL316000
Chemical Name: 2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-4-(methylsulfanyl)butan-1-one
Smiles: CSCCC(C(=O)N1CCN(CC1)C(=O)c1ccco1)Nc1nc(C)cc(n1)C

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Molecular Weight: 417.53
Empirical Formula: C20H27N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.163
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 116
Number of rings: 3

     

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