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DocumentationIdentifier: MM100656
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM100656 |
| SMILES |
C=CCCCCF
|
| InChIKey |
WUMVRHNZIRFDQL-UHFFFAOYSA-N
|
| MW [Da] |
102.15
Automatically obtained from RDkit software. |
| LogP |
2.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM125754
Similarity: 0.75
Similarity to MM125754
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 116.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM125562
Similarity: 0.7368
Similarity to MM125562
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.852 |
| Dice metric | 0.8485 |
| MW: | 116.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM105539
Similarity: 0.7143
Similarity to MM105539
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 120.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+727 more
