General Information of the Compound
Compound ID
CP0948218
Compound Name
Thieno[3,2-b]furan-5-ylmethanamine
    Show/Hide
Structure
Formula
C7H7NOS
Molecular Weight
153.206
Canonical SMILES
NCc1cc2occc2s1
    Show/Hide
InChI
InChI=1S/C7H7NOS/c8-4-5-3-6-7(10-5)1-2-9-6/h1-3H,4,8H2
    Show/Hide
InChIKey
MIBPQOWRFXVNFJ-UHFFFAOYSA-N
Physicochemical Property
logP
1.953
Rotatable Bonds
1
Heavy Atom Count
10
Polar Areas
39.16
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
10

"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: 54594787
ChEMBL ID
CHEMBL4589671
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: PT04868, Lysyl oxidase homolog 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 > 1000 nM
   TI
   LI
   LO
   TS