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DocumentationIdentifier: MM288319
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM288319 |
| SMILES |
C=CCC#CCCC(=O)O
|
| InChIKey |
HOOMLEDOKDJUJT-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
1.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM153463
Similarity: 0.8108
Similarity to MM153463
| Tanimoto metric | 0.8108 |
|---|---|
| Cosine metric | 0.9005 |
| Dice metric | 0.8955 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM288293
Similarity: 0.7895
Similarity to MM288293
| Tanimoto metric | 0.7895 |
|---|---|
| Cosine metric | 0.8858 |
| Dice metric | 0.8824 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM153498
Similarity: 0.7778
Similarity to MM153498
| Tanimoto metric | 0.7778 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.875 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+475 more
