COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549209
Chemical Name: 3-ethyl-6-hydroxy-2-(octylsulfanyl)-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4(3H)-one
Smiles: CCCCCCCCSc1nc(O)c(c(=O)n1CC)C1NCCc2c1cccc2

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Molecular Weight: 415.6
Empirical Formula: C23H33N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.678
Rotatable bonds: 11
H-donors: 2
H-acceptors: 2
PSA: 90
Number of rings: 3

     

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