COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK562027
Chemical Name: 8-(3,4-dihydroisoquinolin-2(1H)-yl)-6-hydroxy-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-2H-purin-2-one
Smiles: Cn1c(=O)nc(c2c1nc(n2CCSc1nnnn1c1ccccc1)N1CCc2c(C1)cccc2)O

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Molecular Weight: 501.57
Empirical Formula: C24H23N9O2S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 3.21
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 142
Number of rings: 6

     

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