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DocumentationIdentifier: MM239195
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM239195 |
| SMILES |
CCCCCC(C)(O)CO
|
| InChIKey |
UBNIJVDFUWZODL-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
1.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM138088
Similarity: 0.8974
Similarity to MM138088
| Tanimoto metric | 0.8974 |
|---|---|
| Cosine metric | 0.9473 |
| Dice metric | 0.9459 |
| MW: | 132.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227748
Similarity: 0.814
Similarity to MM227748
| Tanimoto metric | 0.814 |
|---|---|
| Cosine metric | 0.8974 |
| Dice metric | 0.8974 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM77074
Similarity: 0.7609
Similarity to MM77074
| Tanimoto metric | 0.7609 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8642 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+674 more
