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DocumentationIdentifier: MM353088
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM353088 |
| SMILES |
C=C(CCCCF)C(C)O
|
| InChIKey |
YLTBSBKOJSUBTO-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
2.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM352778
Similarity: 0.8
Similarity to MM352778
| Tanimoto metric | 0.8 |
|---|---|
| Cosine metric | 0.8944 |
| Dice metric | 0.8889 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM352988
Similarity: 0.7542
Similarity to MM352988
| Tanimoto metric | 0.7542 |
|---|---|
| Cosine metric | 0.8628 |
| Dice metric | 0.8599 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM331295
Similarity: 0.7379
Similarity to MM331295
| Tanimoto metric | 0.7379 |
|---|---|
| Cosine metric | 0.8508 |
| Dice metric | 0.8492 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+587 more
