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DocumentationIdentifier: MM438706
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM438706 |
| SMILES |
C=CCOC=C(C=C)CC
|
| InChIKey |
FPOYVMJYGSTOBS-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
2.67
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM201725
Similarity: 0.8588
Similarity to MM201725
| Tanimoto metric | 0.8588 |
|---|---|
| Cosine metric | 0.9267 |
| Dice metric | 0.9241 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM295191
Similarity: 0.8125
Similarity to MM295191
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.8968 |
| Dice metric | 0.8966 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM437976
Similarity: 0.7979
Similarity to MM437976
| Tanimoto metric | 0.7979 |
|---|---|
| Cosine metric | 0.8876 |
| Dice metric | 0.8876 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+428 more
