COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL411004
Chemical Name: 2-(2-methoxyethyl)-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Smiles: CSCCC(c1nnc2n1cccc2)NC(=O)c1cn(CCOC)c(=O)c2c1cccc2

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Molecular Weight: 451.55
Empirical Formula: C23H25N5O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.687
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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