Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM326192
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM326192 |
| SMILES |
CCC(CC(C)C#N)OC
|
| InChIKey |
UJRGIFGOIRKYFM-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141684
Similarity: 0.8061
Similarity to MM141684
| Tanimoto metric | 0.8061 |
|---|---|
| Cosine metric | 0.8978 |
| Dice metric | 0.8927 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM02871
Similarity: 0.7315
Similarity to MM02871
| Tanimoto metric | 0.7315 |
|---|---|
| Cosine metric | 0.8459 |
| Dice metric | 0.8449 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM141639
Similarity: 0.7143
Similarity to MM141639
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.31 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+418 more
