COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980012
Chemical Name: 4-[7-acetyl-3-(butylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]benzene-1,3-diyldiacetate
Smiles: CCCCSc1nnc2c(n1)OC(c1ccc(cc1OC(=O)C)OC(=O)C)N(c1c2cccc1)C(=O)C

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Molecular Weight: 522.58
Empirical Formula: C26H26N4O6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.825
Rotatable bonds: 9
H-donors: 0
H-acceptors: 6
PSA: 146
Number of rings: 4

     

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