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DocumentationIdentifier: MM291499
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM291499 |
| SMILES |
C=CCCCC(C)CC=O
|
| InChIKey |
WJEYIRUETSCEBF-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM363829
Similarity: 0.7612
Similarity to MM363829
| Tanimoto metric | 0.7612 |
|---|---|
| Cosine metric | 0.8649 |
| Dice metric | 0.8644 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155925
Similarity: 0.7576
Similarity to MM155925
| Tanimoto metric | 0.7576 |
|---|---|
| Cosine metric | 0.8632 |
| Dice metric | 0.8621 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250711
Similarity: 0.7532
Similarity to MM250711
| Tanimoto metric | 0.7532 |
|---|---|
| Cosine metric | 0.8633 |
| Dice metric | 0.8593 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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