COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK290434
Chemical Name: bis{2-[4-(4-nitrophenoxy)phenyl]-2-oxoethyl}butanedioate
Smiles: O=C(OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-])CCC(=O)OCC(=O)c1ccc(cc1)Oc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 628.55
Empirical Formula: C32H24N2O12

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 7.08
Rotatable bonds: 9
H-donors: 0
H-acceptors: 12
PSA: 196
Number of rings: 4

     

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