COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK520906
Chemical Name: 1-{6-[2-(benzyloxy)-5-chlorophenyl]-3-(propylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl}ethanone
Smiles: CCCSc1nnc2c(n1)OC(c1cc(Cl)ccc1OCc1ccccc1)N(c1c2cccc1)C(=O)C

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Molecular Weight: 533.05
Empirical Formula: C28H25ClN4O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.878
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 102
Number of rings: 5

     

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