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DocumentationIdentifier: MM293238
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM293238 |
| SMILES |
C=C(CCF)C(C)CC=O
|
| InChIKey |
OIPRNRWDVYGFEY-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.13
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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MM172496
Similarity: 0.7353
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| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8575 |
| Dice metric | 0.8475 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM172877
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| Tanimoto metric | 0.7157 |
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| Cosine metric | 0.846 |
| Dice metric | 0.8343 |
| MW: | 130.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.95 |
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|---|---|---|---|---|---|
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MM377536
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Similarity to MM377536
| Tanimoto metric | 0.7087 |
|---|---|
| Cosine metric | 0.831 |
| Dice metric | 0.8295 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+218 more
