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DocumentationIdentifier: MM290863
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM290863 |
| SMILES |
CC1N(CCC#N)C1(C)C
|
| InChIKey |
JSEAHHZYANEWDZ-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
MM290799
Similarity: 0.7658
Similarity to MM290799
| Tanimoto metric | 0.7658 |
|---|---|
| Cosine metric | 0.8677 |
| Dice metric | 0.8674 |
| MW: | 142.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.82 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM346233
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Similarity to MM346233
| Tanimoto metric | 0.7423 |
|---|---|
| Cosine metric | 0.8521 |
| Dice metric | 0.8521 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM155266
Similarity: 0.7343
Similarity to MM155266
| Tanimoto metric | 0.7343 |
|---|---|
| Cosine metric | 0.8569 |
| Dice metric | 0.8468 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.99 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+194 more
