COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL168404
Chemical Name: ethyl2-({[(5-benzyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Smiles: CCOC(=O)c1c(NC(=O)CSc2nnc3c(n2)n(Cc2ccccc2)c2c3cccc2)sc2c1CCC2

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Molecular Weight: 543.67
Empirical Formula: C28H25N5O3S2

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 7.153
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 152
Number of rings: 6

     

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