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DocumentationIdentifier: MM359286
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM359286 |
| SMILES |
COC=CC(O)C=COC
|
| InChIKey |
NCLHGWFNGRCUNJ-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM114117
Similarity: 0.8983
Similarity to MM114117
| Tanimoto metric | 0.8983 |
|---|---|
| Cosine metric | 0.9478 |
| Dice metric | 0.9464 |
| MW: | 114.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM169620
Similarity: 0.7606
Similarity to MM169620
| Tanimoto metric | 0.7606 |
|---|---|
| Cosine metric | 0.8654 |
| Dice metric | 0.864 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM169702
Similarity: 0.7571
Similarity to MM169702
| Tanimoto metric | 0.7571 |
|---|---|
| Cosine metric | 0.8625 |
| Dice metric | 0.8618 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+436 more
