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DocumentationIdentifier: MM343614
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM343614 |
| SMILES |
C=C(CCO)C(=C)C(C)O
|
| InChIKey |
HHUFSAMYVZZRRH-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.86
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM372046
Similarity: 0.8468
Similarity to MM372046
| Tanimoto metric | 0.8468 |
|---|---|
| Cosine metric | 0.9202 |
| Dice metric | 0.9171 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351799
Similarity: 0.8092
Similarity to MM351799
| Tanimoto metric | 0.8092 |
|---|---|
| Cosine metric | 0.8963 |
| Dice metric | 0.8945 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.86 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM372454
Similarity: 0.784
Similarity to MM372454
| Tanimoto metric | 0.784 |
|---|---|
| Cosine metric | 0.8789 |
| Dice metric | 0.8789 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+385 more
