COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521848
Chemical Name: 1-{3-[(2-chlorobenzyl)sulfanyl]-6-(2,4,6-trimethoxyphenyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl}ethanone
Smiles: COc1cc(OC)cc(c1C1Oc2nc(nnc2c2c(N1C(=O)C)cccc2)SCc1ccccc1Cl)OC

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Molecular Weight: 565.05
Empirical Formula: C28H25ClN4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.316
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 121
Number of rings: 5

     

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