COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521935
Chemical Name: 1-{3-[(2-chlorobenzyl)sulfanyl]-6-(3-ethoxy-4-methoxyphenyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl}ethanone
Smiles: CCOc1cc(ccc1OC)C1Oc2nc(nnc2c2c(N1C(=O)C)cccc2)SCc1ccccc1Cl

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Molecular Weight: 549.05
Empirical Formula: C28H25ClN4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.198
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 5

     

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