COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK980034
Chemical Name: ethyl4-{5-[7-acetyl-3-(butylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]furan-2-yl}benzoate
Smiles: CCCCSc1nnc2c(n1)OC(c1ccc(o1)c1ccc(cc1)C(=O)OCC)N(c1c2cccc1)C(=O)C

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Molecular Weight: 544.63
Empirical Formula: C29H28N4O5S

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 6.501
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 132
Number of rings: 5

     

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