COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509485
Chemical Name: 1-[10-bromo-6-(4-ethylphenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CCc1ccc(cc1)C1Oc2nc(SC)nnc2c2c(N1C(=O)C)ccc(c2)Br

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Molecular Weight: 471.38
Empirical Formula: C21H19BrN4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.321
Rotatable bonds: 1
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 4

     

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