COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK979841
Chemical Name: 4-bromo-3-[3-(butylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenol
Smiles: CCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(O)ccc1Br

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Molecular Weight: 459.37
Empirical Formula: C20H19BrN4O2S

Physical State: Dry powder
Available Amount: 46 mg

Lipinsky:
logP: 4.821
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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