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DocumentationIdentifier: MM68755
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM68755 |
| SMILES |
C=C(C)CC(O)(CC)CN
|
| InChIKey |
FKBQFFJJVWDDIP-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
MM243012
Similarity: 0.7887
Similarity to MM243012
| Tanimoto metric | 0.7887 |
|---|---|
| Cosine metric | 0.8841 |
| Dice metric | 0.8819 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68991
Similarity: 0.75
Similarity to MM68991
| Tanimoto metric | 0.75 |
|---|---|
| Cosine metric | 0.866 |
| Dice metric | 0.8571 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68994
Similarity: 0.6879
Similarity to MM68994
| Tanimoto metric | 0.6879 |
|---|---|
| Cosine metric | 0.8154 |
| Dice metric | 0.8151 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+368 more
