COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521850
Chemical Name: 1-{3-[(2-chlorobenzyl)sulfanyl]-6-[4-(trifluoromethyl)phenyl][1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl}ethanone
Smiles: CC(=O)N1c2ccccc2c2c(OC1c1ccc(cc1)C(F)(F)F)nc(nn2)SCc1ccccc1Cl

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Molecular Weight: 542.97
Empirical Formula: C26H18ClF3N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 6.501
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 5

     

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