COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157999
Chemical Name: 4-(4-methylphenyl)-2-{5-[4-(methylsulfonyl)piperazin-1-yl]-2-nitrophenyl}phthalazin-1(2H)-one
Smiles: Cc1ccc(cc1)c1nn(c(=O)c2c1cccc2)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)S(=O)(=O)C

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Molecular Weight: 519.58
Empirical Formula: C26H25N5O5S

Physical State: Dry powder
Available Amount: 415 mg

Lipinsky:
logP: 3.701
Rotatable bonds: 0
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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