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DocumentationIdentifier: MM393060
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM393060 |
| SMILES |
C=CCCC(CF)C(=O)O
|
| InChIKey |
GUWCOEOCCVNACY-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.62
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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MM179800
Similarity: 0.8049
Similarity to MM179800
| Tanimoto metric | 0.8049 |
|---|---|
| Cosine metric | 0.8971 |
| Dice metric | 0.8919 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM392849
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Similarity to MM392849
| Tanimoto metric | 0.7174 |
|---|---|
| Cosine metric | 0.836 |
| Dice metric | 0.8354 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.41 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM306774
Similarity: 0.6471
Similarity to MM306774
| Tanimoto metric | 0.6471 |
|---|---|
| Cosine metric | 0.7859 |
| Dice metric | 0.7857 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+261 more
