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DocumentationIdentifier: MM156368
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM156368 |
| SMILES |
C=CCC(=C)CCCC
|
| InChIKey |
ZPCNDGRBQCQTMF-UHFFFAOYSA-N
|
| MW [Da] |
124.23
Automatically obtained from RDkit software. |
| LogP |
3.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM292247
Similarity: 0.9216
Similarity to MM292247
| Tanimoto metric | 0.9216 |
|---|---|
| Cosine metric | 0.96 |
| Dice metric | 0.9592 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM292034
Similarity: 0.9216
Similarity to MM292034
| Tanimoto metric | 0.9216 |
|---|---|
| Cosine metric | 0.96 |
| Dice metric | 0.9592 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM107345
Similarity: 0.8511
Similarity to MM107345
| Tanimoto metric | 0.8511 |
|---|---|
| Cosine metric | 0.9225 |
| Dice metric | 0.9195 |
| MW: | 110.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+679 more
