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DocumentationIdentifier: MM378141
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM378141 |
| SMILES |
C=CC(CC(C)O)C(=C)C
|
| InChIKey |
AUPHGJYOODSLOJ-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM387668
Similarity: 0.8108
Similarity to MM387668
| Tanimoto metric | 0.8108 |
|---|---|
| Cosine metric | 0.9005 |
| Dice metric | 0.8955 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.97 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370950
Similarity: 0.7042
Similarity to MM370950
| Tanimoto metric | 0.7042 |
|---|---|
| Cosine metric | 0.8293 |
| Dice metric | 0.8264 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM330576
Similarity: 0.6953
Similarity to MM330576
| Tanimoto metric | 0.6953 |
|---|---|
| Cosine metric | 0.8205 |
| Dice metric | 0.8203 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+243 more
