COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK175364
Chemical Name: 2-(5-{4-[(4-chlorophenyl)carbonyl]piperazin-1-yl}-2-nitrophenyl)-4-(4-methylphenyl)phthalazin-1(2H)-one
Smiles: Cc1ccc(cc1)c1nn(c2cc(ccc2[N+](=O)[O-])N2CCN(CC2)C(=O)c2ccc(cc2)Cl)c(=O)c2c1cccc2

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Molecular Weight: 580.04
Empirical Formula: C32H26ClN5O4

Physical State: Dry powder
Available Amount: 172 mg

Lipinsky:
logP: 5.073
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 6

     

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