General Information of the Compound
Compound ID
CP0552217
Compound Name
[7-(carbamoylamino)-9-oxofluoren-2-yl]urea
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Structure
Formula
C15H12N4O3
Molecular Weight
296.286
Canonical SMILES
NC(=O)Nc1ccc2-c3ccc(NC(N)=O)cc3C(=O)c2c1
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InChI
InChI=1S/C15H12N4O3/c16-14(21)18-7-1-3-9-10-4-2-8(19-15(17)22)6-12(10)13(20)11(9)5-7/h1-6H,(H3,16,18,21)(H3,17,19,22)
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InChIKey
BFSBXEJALMQLHW-UHFFFAOYSA-N
Physicochemical Property
logP
1.8792
Rotatable Bonds
2
Heavy Atom Count
22
Polar Areas
127.31
Hydrogen Bond Donor Count
4
Hydrogen Bond Acceptor Count
3
Complexity
22

"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: 127038161
ChEMBL ID
CHEMBL3741585
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 = 2000 nM
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