COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169924
Chemical Name: 6-(4-methoxy-3-nitrophenyl)-3-(propylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: CCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(c(c1)[N+](=O)[O-])OC

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Molecular Weight: 425.47
Empirical Formula: C20H19N5O4S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.53
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 4

     

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