COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675664
Chemical Name: 4,4'-{propane-2,2-diylbis[(2,6-dibromobenzene-4,1-diyl)oxy]}bis(3-nitrobenzonitrile)
Smiles: N#Cc1ccc(c(c1)[N+](=O)[O-])Oc1c(Br)cc(cc1Br)C(c1cc(Br)c(c(c1)Br)Oc1ccc(cc1[N+](=O)[O-])C#N)(C)C

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Molecular Weight: 836.09
Empirical Formula: C29H16Br4N4O6

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 9.675
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 157
Number of rings: 4

     

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