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DocumentationIdentifier: MM448398
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM448398 |
| SMILES |
CN(CCF)C(=O)C=CN
|
| InChIKey |
UEDRUUUSPXHOAN-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
-0.11
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM448105
Similarity: 0.7563
Similarity to MM448105
| Tanimoto metric | 0.7563 |
|---|---|
| Cosine metric | 0.8697 |
| Dice metric | 0.8612 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM448419
Similarity: 0.687
Similarity to MM448419
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8169 |
| Dice metric | 0.8145 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM290546
Similarity: 0.5743
Similarity to MM290546
| Tanimoto metric | 0.5743 |
|---|---|
| Cosine metric | 0.7298 |
| Dice metric | 0.7296 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+283 more
