COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK612955
Chemical Name: 6-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)carbonyl]-2-(2-phenoxyethyl)pyridazin-3(2H)-one
Smiles: O=C(N1CCc2c(C1C)cc1c(c2)OCCCO1)c1ccc(=O)n(n1)CCOc1ccccc1

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Molecular Weight: 461.52
Empirical Formula: C26H27N3O5

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 2.513
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 80
Number of rings: 5

     

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