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DocumentationIdentifier: MM327784
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM327784 |
| SMILES |
CCC1(C)CN1C(C)C#N
|
| InChIKey |
DDBDXDCODSTCPA-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM176989
Similarity: 0.8304
Similarity to MM176989
| Tanimoto metric | 0.8304 |
|---|---|
| Cosine metric | 0.9113 |
| Dice metric | 0.9073 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM430928
Similarity: 0.7435
Similarity to MM430928
| Tanimoto metric | 0.7435 |
|---|---|
| Cosine metric | 0.8532 |
| Dice metric | 0.8529 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM314286
Similarity: 0.7368
Similarity to MM314286
| Tanimoto metric | 0.7368 |
|---|---|
| Cosine metric | 0.849 |
| Dice metric | 0.8485 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+273 more
