COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK616844
Chemical Name: 2-(3-methylphenyl)-6-[(7-methyl-3,4,9,10-tetrahydro-2H-[1,4]dioxepino[2,3-g]isoquinolin-8(7H)-yl)carbonyl]-4,5-dihydropyridazin-3(2H)-one
Smiles: Cc1cccc(c1)N1N=C(CCC1=O)C(=O)N1CCc2c(C1C)cc1c(c2)OCCCO1

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Molecular Weight: 433.51
Empirical Formula: C25H27N3O4

Physical State: Dry powder
Available Amount: 303 mg

Lipinsky:
logP: 1.868
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 71
Number of rings: 5

     

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