COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521795
Chemical Name: 4-[7-acetyl-3-(ethylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]benzene-1,2-diyldiacetate
Smiles: CCSc1nnc2c(n1)OC(c1ccc(c(c1)OC(=O)C)OC(=O)C)N(c1c2cccc1)C(=O)C

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Molecular Weight: 494.53
Empirical Formula: C24H22N4O6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.412
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 146
Number of rings: 4

     

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