COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK157823
Chemical Name: 4-(4-chlorophenyl)-2-[2-nitro-5-(4-propanoylpiperazin-1-yl)phenyl]phthalazin-1(2H)-one
Smiles: CCC(=O)N1CCN(CC1)c1ccc(c(c1)n1nc(c2ccc(cc2)Cl)c2c(c1=O)cccc2)[N+](=O)[O-]

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Molecular Weight: 517.97
Empirical Formula: C27H24ClN5O4

Physical State: Dry powder
Available Amount: 503 mg

Lipinsky:
logP: 4.267
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 102
Number of rings: 5

     

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