General Information of the Compound
| Compound ID |
CP0435509
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-(diaminomethylidene)-5-(3,5-dimethylphenyl)furan-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H15N3O2
|
||||||||||||||||||
| Molecular Weight |
257.293
|
||||||||||||||||||
| Canonical SMILES |
Cc1cc(C)cc(c1)-c1ccc(o1)C(=O)NC(N)=N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H15N3O2/c1-8-5-9(2)7-10(6-8)11-3-4-12(19-11)13(18)17-14(15)16/h3-7H,1-2H3,(H4,15,16,17,18)
Show/Hide
|
||||||||||||||||||
| InChIKey |
XKDSBDBLVGIDSJ-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