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DocumentationIdentifier: MM266392
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM266392 |
| SMILES |
COC(C)=CC(N)CCN
|
| InChIKey |
HWLNAXBOYCKKDI-UHFFFAOYSA-N
|
| MW [Da] |
144.22
Automatically obtained from RDkit software. |
| LogP |
0.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM143322
Similarity: 0.822
Similarity to MM143322
| Tanimoto metric | 0.822 |
|---|---|
| Cosine metric | 0.9067 |
| Dice metric | 0.9023 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM266437
Similarity: 0.7153
Similarity to MM266437
| Tanimoto metric | 0.7153 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.834 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM337010
Similarity: 0.6966
Similarity to MM337010
| Tanimoto metric | 0.6966 |
|---|---|
| Cosine metric | 0.8218 |
| Dice metric | 0.8211 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+389 more
