COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326176
Chemical Name: (4-bromo-2-{3-[(2-chlorobenzyl)sulfanyl]-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl}phenoxy)aceticacid
Smiles: OC(=O)COc1ccc(cc1C1Oc2nc(nnc2c2c(N1)cccc2)SCc1ccccc1Cl)Br

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Molecular Weight: 585.87
Empirical Formula: C25H18BrClN4O4S

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 5.482
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 131
Number of rings: 5

     

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