General Information of the Compound
Compound ID
CP0515184
Compound Name
1-(5-chloro-2-hydroxyphenyl)-3-phenylurea
    Show/Hide
Structure
Formula
C13H11ClN2O2
Molecular Weight
262.696
Canonical SMILES
Oc1ccc(Cl)cc1NC(=O)Nc1ccccc1
    Show/Hide
InChI
InChI=1S/C13H11ClN2O2/c14-9-6-7-12(17)11(8-9)16-13(18)15-10-4-2-1-3-5-10/h1-8,17H,(H2,15,16,18)
    Show/Hide
InChIKey
CKBQQMKRHAXSQO-UHFFFAOYSA-N
Physicochemical Property
logP
3.6896
Rotatable Bonds
2
Heavy Atom Count
18
Polar Areas
61.36
Hydrogen Bond Donor Count
3
Hydrogen Bond Acceptor Count
2
Complexity
18

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 314241
SID: 15247222
ChEMBL ID
CHEMBL392821
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: PT01013, C-X-C chemokine receptor type 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 > 30000 nM
   TI
   LI
   LO
   TS