COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL096937
Chemical Name: 4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-2-(3-bromophenyl)phthalazin-1(2H)-one
Smiles: Brc1cccc(c1)n1nc(c2onc(n2)c2ccc3c(c2)OCO3)c2c(c1=O)cccc2

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Molecular Weight: 489.28
Empirical Formula: C23H13BrN4O4

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.537
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 90
Number of rings: 6

     

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