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DocumentationIdentifier: MM263021
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263021 |
| SMILES |
C=C(CC)CC(=C)CCC
|
| InChIKey |
DTAQEBYWKHNNLW-UHFFFAOYSA-N
|
| MW [Da] |
138.25
Automatically obtained from RDkit software. |
| LogP |
3.7
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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MM292034
Similarity: 0.9091
Similarity to MM292034
| Tanimoto metric | 0.9091 |
|---|---|
| Cosine metric | 0.9528 |
| Dice metric | 0.9524 |
| MW: | 138.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM223273
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| Tanimoto metric | 0.8667 |
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| Cosine metric | 0.9292 |
| Dice metric | 0.9286 |
| MW: | 136.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.48 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM142517
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Similarity to MM142517
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 124.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+473 more
