COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527453
Chemical Name: 2-({2-[(1S)-6,7-dimethoxy-1-methyl-3,4-dihydroisoquinolin-2(1H)-yl]-2-oxoethyl}sulfanyl)-6-hydroxy-5-(propan-2-yl)pyrimidin-4(3H)-one
Smiles: COc1cc2c(cc1OC)CCN([C@H]2C)C(=O)CSc1nc(O)c(c(=O)[nH]1)C(C)C

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Molecular Weight: 433.53
Empirical Formula: C21H27N3O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.316
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 125
Number of rings: 3

     

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