COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK290207
Chemical Name: 2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl4-[(3,4-dichlorophenyl)amino]-4-oxobutanoate
Smiles: O=C(Nc1ccc(c(c1)Cl)Cl)CCC(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 517.32
Empirical Formula: C24H18Cl2N2O7

Physical State: Dry powder
Available Amount: 109 mg

Lipinsky:
logP: 6.357
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 127
Number of rings: 3

     

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