COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK829739
Chemical Name: 2-({2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}sulfanyl)pyridine-3-carboxylicacid
Smiles: O=C(CSc1ncccc1C(=O)O)NCc1ccc2c(c1)OCO2

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Molecular Weight: 346.36
Empirical Formula: C16H14N2O5S

Physical State: Dry powder
Available Amount: 81 mg

Lipinsky:
logP: 1.481
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 3

     

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