| BioID | bio199154 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL473459 |
|---|
| Molecular Formula | C16H12O3 |
|---|
| Molecular Weight | 252.27 |
|---|
| Molecular Weight (Monoisotopic) | 252.0786 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(4-(Phenylethynyl)Phenoxy)Acetic Acid |
|---|
| Smiles | O=C(O)COc1ccc(C#Cc2ccccc2)cc1 |
|---|
| Inchi | InChI=1S/C16H12O3/c17-16(18)12-19-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11H,12H2,(H,17,18) |
|---|
| Inchi Key | TXUDMMKVFYBXOP-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 3.0 |
|---|
| Bioactivities | 4.0 |
|---|
| Np Likeness Score | -0.73 |
|---|
| Records Key | ['1'] |
|---|
| Records Name | ['2-(4-(Phenylethynyl)phenoxy)acetic acid'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
