General Information of the Compound
Compound ID
CP0869215
Compound Name
N,N'-(9-oxo-9H-fluorene-2,7-diyl)bis(2-(2-methoxyethoxy)acetamide)
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Structure
Formula
C23H26N2O7
Molecular Weight
442.468
Canonical SMILES
COCCOCC(=O)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)COCCOC)ccc1-2
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InChI
InChI=1S/C23H26N2O7/c1-29-7-9-31-13-21(26)24-15-3-5-17-18-6-4-16(12-20(18)23(28)19(17)11-15)25-22(27)14-32-10-8-30-2/h3-6,11-12H,7-10,13-14H2,1-2H3,(H,24,26)(H,25,27)
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InChIKey
QJEFPXFAGWQLFN-UHFFFAOYSA-N
Physicochemical Property
logP
2.101
Rotatable Bonds
12
Heavy Atom Count
32
Polar Areas
112.19
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
7
Complexity
32

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 127039498
ChEMBL ID
CHEMBL3739858
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT06376, Urea transporter 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000922 MDCK-UT-A1-AQP1-YFP Canis lupus familiaris (Dog)  1
1
IC50 > 50000 nM
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