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DocumentationIdentifier: MM71586
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM71586 |
| SMILES |
CCCC(O)C(O)CCO
|
| InChIKey |
IFHAEPAIFCSCJZ-UHFFFAOYSA-N
|
| MW [Da] |
148.2
Automatically obtained from RDkit software. |
| LogP |
-0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171785
Similarity: 0.8571
Similarity to MM171785
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM268278
Similarity: 0.85
Similarity to MM268278
| Tanimoto metric | 0.85 |
|---|---|
| Cosine metric | 0.9203 |
| Dice metric | 0.9189 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM361767
Similarity: 0.7792
Similarity to MM361767
| Tanimoto metric | 0.7792 |
|---|---|
| Cosine metric | 0.8761 |
| Dice metric | 0.8759 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+586 more
