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DocumentationIdentifier: MM304514
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM304514 |
| SMILES |
CN(C)C(=O)CC=CCN
|
| InChIKey |
HAPHZOIQQQKDNX-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
-0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM23583
Similarity: 0.8218
Similarity to MM23583
| Tanimoto metric | 0.8218 |
|---|---|
| Cosine metric | 0.9022 |
| Dice metric | 0.9022 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304512
Similarity: 0.802
Similarity to MM304512
| Tanimoto metric | 0.802 |
|---|---|
| Cosine metric | 0.8902 |
| Dice metric | 0.8901 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM304655
Similarity: 0.7642
Similarity to MM304655
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8664 |
| Dice metric | 0.8663 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+379 more
