General Information of the Compound
Compound ID
CP0381977
Compound Name
N-(3,4-dichlorophenyl)thiophene-3-carboxamide
    Show/Hide
Structure
Formula
C11H7Cl2NOS
Molecular Weight
272.156
Canonical SMILES
Clc1ccc(NC(=O)c2ccsc2)cc1Cl
    Show/Hide
InChI
InChI=1S/C11H7Cl2NOS/c12-9-2-1-8(5-10(9)13)14-11(15)7-3-4-16-6-7/h1-6H,(H,14,15)
    Show/Hide
InChIKey
GKCPOBNJSNOQEH-UHFFFAOYSA-N
Physicochemical Property
logP
4.3072
Rotatable Bonds
2
Heavy Atom Count
16
Polar Areas
29.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
16

"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: 30268259
SID: 85186801
ChEMBL ID
CHEMBL557685
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: PT02199, Metabotropic glutamate receptor 4
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 > 10000 nM
   TI
   LI
   LO
   TS