COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175365
Chemical Name: 4-(4-chlorophenyl)-2-(5-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}-2-nitrophenyl)phthalazin-1(2H)-one
Smiles: Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 580.04
Empirical Formula: C32H26ClN5O4

Physical State: Dry powder
Available Amount: 161 mg

Lipinsky:
logP: 4.904
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 6

     

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