General Information of the Compound
| Compound ID |
CP0535778
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[(2,5-Dihydroxy-benzylidene)-amino]-benzoic acid
Show/Hide
|
||||||||||||||||||
| Formula |
C14H11NO4
|
||||||||||||||||||
| Molecular Weight |
257.245
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)c1cccc(c1)\N=C\c1cc(O)ccc1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H11NO4/c16-12-4-5-13(17)10(7-12)8-15-11-3-1-2-9(6-11)14(18)19/h1-8,16-17H,(H,18,19)/b15-8+
Show/Hide
|
||||||||||||||||||
| InChIKey |
VULKLJVTDOSAHQ-OVCLIPMQSA-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