General Information of the Compound
| Compound ID |
CP0955935
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-((5-((1H-benzo[d]imidazol-2-yl)thio)furan-2-yl)methyl)aniline
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H15N3OS
|
||||||||||||||||||
| Molecular Weight |
321.405
|
||||||||||||||||||
| Canonical SMILES |
c1ccc(NCc2ccc(Sc3nc4ccccc4[nH]3)o2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H15N3OS/c1-2-6-13(7-3-1)19-12-14-10-11-17(22-14)23-18-20-15-8-4-5-9-16(15)21-18/h1-11,19H,12H2,(H,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FEUXPPDZIRWQTA-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"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 | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
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