COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521227
Chemical Name: 1-[3-(methylsulfanyl)-6-(2,4,6-trimethoxyphenyl)[1,2,4]triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]propan-1-one
Smiles: CCC(=O)N1C(Oc2c(c3c1cccc3)nnc(n2)SC)c1c(OC)cc(cc1OC)OC

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Molecular Weight: 468.53
Empirical Formula: C23H24N4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.476
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 121
Number of rings: 4

     

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