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DocumentationIdentifier: MM437156
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM437156 |
| SMILES |
CCC(CC)CC(C)(C)O
|
| InChIKey |
CKWRBDSKVBMYKY-UHFFFAOYSA-N
|
| MW [Da] |
144.26
Automatically obtained from RDkit software. |
| LogP |
2.58
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM415721
Similarity: 0.9118
Similarity to MM415721
| Tanimoto metric | 0.9118 |
|---|---|
| Cosine metric | 0.9549 |
| Dice metric | 0.9538 |
| MW: | 130.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM437151
Similarity: 0.7654
Similarity to MM437151
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8682 |
| Dice metric | 0.8671 |
| MW: | 144.26 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM437928
Similarity: 0.7654
Similarity to MM437928
| Tanimoto metric | 0.7654 |
|---|---|
| Cosine metric | 0.8682 |
| Dice metric | 0.8671 |
| MW: | 144.26 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+613 more
