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DocumentationIdentifier: MM96120
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM96120 |
| SMILES |
CN=CN(C)C(C)CO
|
| InChIKey |
HEBHKZWHUHOGPQ-UHFFFAOYSA-N
|
| MW [Da] |
130.19
Automatically obtained from RDkit software. |
| LogP |
-0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM379296
Similarity: 0.6949
Similarity to MM379296
| Tanimoto metric | 0.6949 |
|---|---|
| Cosine metric | 0.8336 |
| Dice metric | 0.82 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM95372
Similarity: 0.6707
Similarity to MM95372
| Tanimoto metric | 0.6707 |
|---|---|
| Cosine metric | 0.819 |
| Dice metric | 0.8029 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM47929
Similarity: 0.6613
Similarity to MM47929
| Tanimoto metric | 0.6613 |
|---|---|
| Cosine metric | 0.8132 |
| Dice metric | 0.7961 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+264 more
