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DocumentationIdentifier: MM195419
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM195419 |
| SMILES |
CN1CC1CCCC#N
|
| InChIKey |
IHVSGTBWIKQMBF-UHFFFAOYSA-N
|
| MW [Da] |
124.19
Automatically obtained from RDkit software. |
| LogP |
0.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM425936
Similarity: 0.7851
Similarity to MM425936
| Tanimoto metric | 0.7851 |
|---|---|
| Cosine metric | 0.8861 |
| Dice metric | 0.8796 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM195361
Similarity: 0.7379
Similarity to MM195361
| Tanimoto metric | 0.7379 |
|---|---|
| Cosine metric | 0.8508 |
| Dice metric | 0.8492 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM124799
Similarity: 0.7075
Similarity to MM124799
| Tanimoto metric | 0.7075 |
|---|---|
| Cosine metric | 0.8298 |
| Dice metric | 0.8287 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+289 more
