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DocumentationIdentifier: MM269135
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM269135 |
| SMILES |
C=C(CC(C)N)C(O)CC
|
| InChIKey |
CHLGIVGNFURQDY-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.05
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133809
Similarity: 0.8306
Similarity to MM133809
| Tanimoto metric | 0.8306 |
|---|---|
| Cosine metric | 0.9114 |
| Dice metric | 0.9075 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297184
Similarity: 0.7619
Similarity to MM297184
| Tanimoto metric | 0.7619 |
|---|---|
| Cosine metric | 0.8656 |
| Dice metric | 0.8649 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245972
Similarity: 0.7431
Similarity to MM245972
| Tanimoto metric | 0.7431 |
|---|---|
| Cosine metric | 0.8527 |
| Dice metric | 0.8526 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+512 more
