IDL
imidazo[1,2-a]pyridin-3-ylacetic acid
Created: | 2011-11-29 |
Last modified: | 2011-11-29 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 21 |
Chiral Atom Count | 0 |
Bond Count | 22 |
Aromatic Bond Count | 10 |
Chemical Component Summary | |
---|---|
Name | imidazo[1,2-a]pyridin-3-ylacetic acid |
Systematic Name (OpenEye OEToolkits) | 2-imidazo[1,2-a]pyridin-3-ylethanoic acid |
Formula | C9 H8 N2 O2 |
Molecular Weight | 176.172 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)Cc1cnc2ccccn12 |
SMILES | CACTVS | 3.370 | OC(=O)Cc1cnc2ccccn12 |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccn2c(c1)ncc2CC(=O)O |
Canonical SMILES | CACTVS | 3.370 | OC(=O)Cc1cnc2ccccn12 |
Canonical SMILES | OpenEye OEToolkits | 1.7.6 | c1ccn2c(c1)ncc2CC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C9H8N2O2/c12-9(13)5-7-6-10-8-3-1-2-4-11(7)8/h1-4,6H,5H2,(H,12,13) |
InChIKey | InChI | 1.03 | ZVBVKRNOISRONE-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 87284 |