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DocumentationIdentifier: MM343342
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM343342 |
| SMILES |
CC(CCO)C1CC1
|
| InChIKey |
VFSGVPVRMCRJDV-UHFFFAOYSA-N
|
| MW [Da] |
114.19
Automatically obtained from RDkit software. |
| LogP |
1.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM343459
Similarity: 0.7375
Similarity to MM343459
| Tanimoto metric | 0.7375 |
|---|---|
| Cosine metric | 0.8588 |
| Dice metric | 0.8489 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM217489
Similarity: 0.7123
Similarity to MM217489
| Tanimoto metric | 0.7123 |
|---|---|
| Cosine metric | 0.8333 |
| Dice metric | 0.832 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.81 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM124650
Similarity: 0.6857
Similarity to MM124650
| Tanimoto metric | 0.6857 |
|---|---|
| Cosine metric | 0.8136 |
| Dice metric | 0.8136 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+457 more
