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Documentation3-ethenoxy-3-oxopropanoic Acid
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM03550 |
| SMILES |
C=COC(=O)CC(=O)O
|
| InChIKey |
NUDBSRINTSFGPT-UHFFFAOYSA-N
|
| MW [Da] |
130.1
Automatically obtained from RDkit software. |
| LogP |
0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
18179216
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM107397
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| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8749 |
| Dice metric | 0.8671 |
| MW: | 116.12 |
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| PI: | 3
Total passive interactions
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| LogP: | 0.06 |
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| AI: | 0
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| Cosine metric | 0.8749 |
| Dice metric | 0.8671 |
| MW: | 114.1 |
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|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
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| LogP: | 0.26 |
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|---|---|
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Total passive interactions
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| LogP: | 0.71 |
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+178 more
