General Information of the Compound
Compound ID
CP0578455
Compound Name
N3-(4- Morpholino- phenyl)furo [2,3-c] pyridine-2,3- diamine
    Show/Hide
Structure
Formula
C17H18N4O2
Molecular Weight
310.357
Canonical SMILES
Nc1oc2cnccc2c1Nc1ccc(cc1)N1CCOCC1
    Show/Hide
InChI
InChI=1S/C17H18N4O2/c18-17-16(14-5-6-19-11-15(14)23-17)20-12-1-3-13(4-2-12)21-7-9-22-10-8-21/h1-6,11,20H,7-10,18H2
    Show/Hide
InChIKey
OSKMZSUCTQCFGO-UHFFFAOYSA-N
Physicochemical Property
logP
2.9902
Rotatable Bonds
3
Heavy Atom Count
23
Polar Areas
76.55
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
6
Complexity
23

"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: 86581860
ChEMBL ID
CHEMBL4294579
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: PT02896, Tryptophan 2,3-dioxygenase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
IC50 > 2000 nM
   TI
   LI
   LO
   TS