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DocumentationIdentifier: MM315680
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM315680 |
| SMILES |
CC(CCCCO)C1CC1
|
| InChIKey |
ZJUUFRFPKSWOPH-UHFFFAOYSA-N
|
| MW [Da] |
142.24
Automatically obtained from RDkit software. |
| LogP |
2.2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM217489
Similarity: 0.8857
Similarity to MM217489
| Tanimoto metric | 0.8857 |
|---|---|
| Cosine metric | 0.9394 |
| Dice metric | 0.9394 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM312457
Similarity: 0.8406
Similarity to MM312457
| Tanimoto metric | 0.8406 |
|---|---|
| Cosine metric | 0.9141 |
| Dice metric | 0.9134 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM315018
Similarity: 0.8116
Similarity to MM315018
| Tanimoto metric | 0.8116 |
|---|---|
| Cosine metric | 0.8974 |
| Dice metric | 0.896 |
| MW: | 142.24 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+426 more
