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DocumentationIdentifier: MM420079
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM420079 |
| SMILES |
CCCC=COC1CC1C
|
| InChIKey |
KNQYJAPOWXCRMP-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
2.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM124845
Similarity: 0.8788
Similarity to MM124845
| Tanimoto metric | 0.8788 |
|---|---|
| Cosine metric | 0.9374 |
| Dice metric | 0.9355 |
| MW: | 112.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM420199
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Similarity to MM420199
| Tanimoto metric | 0.823 |
|---|---|
| Cosine metric | 0.9036 |
| Dice metric | 0.9029 |
| MW: | 137.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM195568
Similarity: 0.8073
Similarity to MM195568
| Tanimoto metric | 0.8073 |
|---|---|
| Cosine metric | 0.8934 |
| Dice metric | 0.8934 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+310 more
