COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169820
Chemical Name: 2,4,6-tribromo-3-[3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenol
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1c(Br)cc(c(c1Br)O)Br

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Molecular Weight: 631.19
Empirical Formula: C21H19Br3N4O2S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.189
Rotatable bonds: 7
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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