COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL251470
Chemical Name: N-(1,1-dioxidotetrahydrothiophen-3-yl)-2-(4-methoxyphenyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: COc1ccc(cc1)n1cc(C(=O)NC2CCS(=O)(=O)C2)c2c(c1=O)cccc2

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Molecular Weight: 412.47
Empirical Formula: C21H20N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.92
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 101
Number of rings: 4

     

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