COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980109
Chemical Name: 1-[6-(5-methylfuran-2-yl)-3-(methylsulfanyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]butan-1-one
Smiles: CCCC(=O)N1C(Oc2c(c3c1cccc3)nnc(n2)SC)c1ccc(o1)C

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Molecular Weight: 396.47
Empirical Formula: C20H20N4O3S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 4.242
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 106
Number of rings: 4

     

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