COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509413
Chemical Name: 1-[10-bromo-6-(2,3-dichlorophenyl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CSc1nnc2c(n1)OC(N(c1c2cc(Br)cc1)C(=O)C)c1cccc(c1Cl)Cl

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Molecular Weight: 512.21
Empirical Formula: C19H13BrCl2N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.394
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 4

     

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