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DocumentationIdentifier: MM349436
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM349436 |
| SMILES |
C=C(CC)C(C)C(C)C=O
|
| InChIKey |
MFPVDCODAVJLJU-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.42
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160207
Similarity: 0.8077
Similarity to MM160207
| Tanimoto metric | 0.8077 |
|---|---|
| Cosine metric | 0.8987 |
| Dice metric | 0.8936 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.03 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297838
Similarity: 0.7355
Similarity to MM297838
| Tanimoto metric | 0.7355 |
|---|---|
| Cosine metric | 0.8477 |
| Dice metric | 0.8476 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298083
Similarity: 0.7304
Similarity to MM298083
| Tanimoto metric | 0.7304 |
|---|---|
| Cosine metric | 0.8451 |
| Dice metric | 0.8442 |
| MW: | 140.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+341 more
