COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169922
Chemical Name: 6-(2-ethoxy-5-nitrophenyl)-3-(methylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCOc1ccc(cc1C1Nc2ccccc2c2c(O1)nc(SC)nn2)[N+](=O)[O-]

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Molecular Weight: 411.44
Empirical Formula: C19H17N5O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.299
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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