COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK682297
Chemical Name: 4-(3,4-dimethylphenyl)-2-[4-methyl-1-(4-nitrophenyl)piperazin-2-yl]phthalazin-1(2H)-one
Smiles: CN1CCN(C(C1)n1nc(c2ccc(c(c2)C)C)c2c(c1=O)cccc2)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 469.54
Empirical Formula: C27H27N5O3

Physical State: Dry powder
Available Amount: 61 mg

Lipinsky:
logP: 4.979
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 5

     

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