COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL311374
Chemical Name: 1-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(methylsulfanyl)butan-1-one
Smiles: CSCCC(C(=O)N1CCC(CC1)c1nc2c([nH]1)cccc2)Nc1nc(C)cc(n1)C

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Molecular Weight: 438.6
Empirical Formula: C23H30N6OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.981
Rotatable bonds: 5
H-donors: 2
H-acceptors: 1
PSA: 112
Number of rings: 4

     

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