COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK123518
Chemical Name: ethyl6-methyl-2-{[(5H-[1,2,4]triazino[5,6-b]indol-3-ylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc3c(n2)[nH]c2c3cccc2)sc2c1CCN(C2)C

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Molecular Weight: 482.59
Empirical Formula: C22H22N6O3S2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 3.836
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 166
Number of rings: 5

     

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