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DocumentationIdentifier: MM255337
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM255337 |
| SMILES |
CC(N)C=CC(O)C(C)C
|
| InChIKey |
JYEWHQWGJCRYDT-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
0.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM145400
Similarity: 0.8061
Similarity to MM145400
| Tanimoto metric | 0.8061 |
|---|---|
| Cosine metric | 0.8978 |
| Dice metric | 0.8927 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM225049
Similarity: 0.7241
Similarity to MM225049
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8402 |
| Dice metric | 0.84 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM252035
Similarity: 0.7117
Similarity to MM252035
| Tanimoto metric | 0.7117 |
|---|---|
| Cosine metric | 0.832 |
| Dice metric | 0.8316 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+520 more
