COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK509218
Chemical Name: 1-[3-(hexylsulfanyl)-6-[4-(methylsulfanyl)phenyl][1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CCCCCCSc1nnc2c(n1)OC(c1ccc(cc1)SC)N(c1c2cccc1)C(=O)C

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Molecular Weight: 480.66
Empirical Formula: C25H28N4O2S2

Physical State: Dry powder
Available Amount: 101 mg

Lipinsky:
logP: 6.701
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 118
Number of rings: 4

     

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