COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175387
Chemical Name: 2-(5-{4-[(4-tert-butylphenyl)carbonyl]piperazin-1-yl}-2-nitrophenyl)-4-methylphthalazin-1(2H)-one
Smiles: [O-][N+](=O)c1ccc(cc1n1nc(C)c2c(c1=O)cccc2)N1CCN(CC1)C(=O)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 525.61
Empirical Formula: C30H31N5O4

Physical State: Dry powder
Available Amount: 192 mg

Lipinsky:
logP: 3.784
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 5

     

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