COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK979916
Chemical Name: 2,6-dibromo-4-[3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenol
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1cc(Br)c(c(c1)Br)O

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Molecular Weight: 552.29
Empirical Formula: C21H20Br2N4O2S

Available Amount: 0 mg

Lipinsky:
logP: 6.275
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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