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DocumentationIdentifier: MM350759
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350759 |
| SMILES |
C=C(CCCO)C(O)C=O
|
| InChIKey |
GMNRBARDZQSGIV-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM173234
Similarity: 0.8584
Similarity to MM173234
| Tanimoto metric | 0.8584 |
|---|---|
| Cosine metric | 0.9265 |
| Dice metric | 0.9238 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351091
Similarity: 0.7903
Similarity to MM351091
| Tanimoto metric | 0.7903 |
|---|---|
| Cosine metric | 0.883 |
| Dice metric | 0.8829 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351087
Similarity: 0.7405
Similarity to MM351087
| Tanimoto metric | 0.7405 |
|---|---|
| Cosine metric | 0.8509 |
| Dice metric | 0.8509 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+208 more
