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DocumentationIdentifier: MM305066
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM305066 |
| SMILES |
C#CC=COC(=C)C(=C)C
|
| InChIKey |
BHJJMYNPFDRVHG-UHFFFAOYSA-N
|
| MW [Da] |
134.18
Automatically obtained from RDkit software. |
| LogP |
2.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM168866
Similarity: 0.6796
Similarity to MM168866
| Tanimoto metric | 0.6796 |
|---|---|
| Cosine metric | 0.8244 |
| Dice metric | 0.8092 |
| MW: | 120.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108542
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Similarity to MM108542
| Tanimoto metric | 0.6699 |
|---|---|
| Cosine metric | 0.8185 |
| Dice metric | 0.8023 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM354979
Similarity: 0.6693
Similarity to MM354979
| Tanimoto metric | 0.6693 |
|---|---|
| Cosine metric | 0.8022 |
| Dice metric | 0.8019 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+172 more
