COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521758
Chemical Name: 1-[3-(ethylsulfanyl)-6-[4-(methylsulfanyl)phenyl][1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone
Smiles: CCSc1nnc2c(n1)OC(c1ccc(cc1)SC)N(c1c2cccc1)C(=O)C

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Molecular Weight: 424.55
Empirical Formula: C21H20N4O2S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 4.575
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 118
Number of rings: 4

     

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