COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326329
Chemical Name: 1-[3-(methylsulfanyl)-6-(thiophen-2-yl)[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)c1cccs1

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Molecular Weight: 398.51
Empirical Formula: C19H18N4O2S2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 4.298
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 121
Number of rings: 4

     

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