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DocumentationIdentifier: MM244834
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244834 |
| SMILES |
CC(C#N)CC(C)N(C)C
|
| InChIKey |
QSMHQVHRBXQJBN-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141678
Similarity: 0.8125
Similarity to MM141678
| Tanimoto metric | 0.8125 |
|---|---|
| Cosine metric | 0.9014 |
| Dice metric | 0.8966 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133522
Similarity: 0.6771
Similarity to MM133522
| Tanimoto metric | 0.6771 |
|---|---|
| Cosine metric | 0.8229 |
| Dice metric | 0.8075 |
| MW: | 129.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326171
Similarity: 0.6724
Similarity to MM326171
| Tanimoto metric | 0.6724 |
|---|---|
| Cosine metric | 0.8042 |
| Dice metric | 0.8041 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+530 more
