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DocumentationIdentifier: MM80278
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM80278 |
| SMILES |
C=CCC(C)(O)C(N)CC
|
| InChIKey |
CVOSIAAVEQLLPE-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
MM77037
Similarity: 0.7589
Similarity to MM77037
| Tanimoto metric | 0.7589 |
|---|---|
| Cosine metric | 0.8711 |
| Dice metric | 0.8629 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243012
Similarity: 0.671
Similarity to MM243012
| Tanimoto metric | 0.671 |
|---|---|
| Cosine metric | 0.8063 |
| Dice metric | 0.8031 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM80297
Similarity: 0.6433
Similarity to MM80297
| Tanimoto metric | 0.6433 |
|---|---|
| Cosine metric | 0.7864 |
| Dice metric | 0.7829 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+278 more
