COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK776731
Chemical Name: methyl4,5-dimethoxy-2-({[(5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1cc(OC)c(cc1NC(=O)CSc1nnc2c(n1)n(C)c1c2cccc1)OC

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Molecular Weight: 467.51
Empirical Formula: C22H21N5O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.958
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 142
Number of rings: 4

     

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