COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK787035
Chemical Name: 2-{[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-oxoethyl]sulfanyl}-7-hydroxy-5-oxo-4,5-dihydrothieno[3,2-b]pyridine-3-carbonitrile
Smiles: N#Cc1c(SCC(=O)c2ccc3c(c2)OCCO3)sc2c1[nH]c(=O)cc2O

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Molecular Weight: 400.44
Empirical Formula: C18H12N2O5S2

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.575
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 162
Number of rings: 4

     

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