COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK171960
Chemical Name: 2-(5-{4-[(3-ethoxyphenyl)carbonyl]piperazin-1-yl}-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
Smiles: CCOc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(C)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 513.55
Empirical Formula: C28H27N5O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 3.193
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 5

     

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