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DocumentationIdentifier: MM330983
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM330983 |
| SMILES |
CN=C(C)NC(CN)CO
|
| InChIKey |
MJAVILWOEZEODO-UHFFFAOYSA-N
|
| MW [Da] |
145.21
Automatically obtained from RDkit software. |
| LogP |
-1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149929
Similarity: 0.7642
Similarity to MM149929
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8742 |
| Dice metric | 0.8664 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM330985
Similarity: 0.6617
Similarity to MM330985
| Tanimoto metric | 0.6617 |
|---|---|
| Cosine metric | 0.8015 |
| Dice metric | 0.7964 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM199451
Similarity: 0.6585
Similarity to MM199451
| Tanimoto metric | 0.6585 |
|---|---|
| Cosine metric | 0.8115 |
| Dice metric | 0.7941 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+149 more
