COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509269
Chemical Name: 1-[6-(6-chloro-1,3-benzodioxol-5-yl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CSc1nnc2c(n1)OC(c1cc3OCOc3cc1Cl)N(c1c2cccc1)C(=O)C

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Molecular Weight: 442.88
Empirical Formula: C20H15ClN4O4S

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 4.147
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 5

     

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