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DocumentationIdentifier: MM300407
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM300407 |
| SMILES |
C=CC(C=C)=C(C)C(C)C
|
| InChIKey |
KOFXCKXWEFTPRB-UHFFFAOYSA-N
|
| MW [Da] |
136.24
Automatically obtained from RDkit software. |
| LogP |
3.33
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161726
Similarity: 0.8734
Similarity to MM161726
| Tanimoto metric | 0.8734 |
|---|---|
| Cosine metric | 0.9346 |
| Dice metric | 0.9324 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224056
Similarity: 0.7263
Similarity to MM224056
| Tanimoto metric | 0.7263 |
|---|---|
| Cosine metric | 0.842 |
| Dice metric | 0.8415 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300323
Similarity: 0.7041
Similarity to MM300323
| Tanimoto metric | 0.7041 |
|---|---|
| Cosine metric | 0.8275 |
| Dice metric | 0.8263 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+543 more
