COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326320
Chemical Name: 4-{3-[(4-chlorobenzyl)sulfanyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl}-2-ethoxyphenol
Smiles: CCOc1cc(ccc1O)C1Oc2nc(SCc3ccc(cc3)Cl)nnc2c2c(N1)cccc2

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Molecular Weight: 492.99
Empirical Formula: C25H21ClN4O3S

Physical State: Dry powder
Available Amount: 188 mg

Lipinsky:
logP: 4.827
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 114
Number of rings: 5

     

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