COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL339878
Chemical Name: 3-(2-ethoxyphenyl)-6-hydroxy-2-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-5-(1,2,3,4-tetrahydroisoquinolin-1-yl)pyrimidin-4(3H)-one
Smiles: CCOc1ccccc1n1c(SCC(=O)c2ccc(cc2)C)nc(c(c1=O)C1NCCc2c1cccc2)O

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Molecular Weight: 527.64
Empirical Formula: C30H29N3O4S

Physical State: Dry powder
Available Amount: 118 mg

Lipinsky:
logP: 6.565
Rotatable bonds: 7
H-donors: 2
H-acceptors: 4
PSA: 116
Number of rings: 5

     

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