Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM363586
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363586 |
| SMILES |
CCCNCCC(C)C#N
|
| InChIKey |
HRCGKWMVFWDNRJ-UHFFFAOYSA-N
|
| MW [Da] |
140.23
Automatically obtained from RDkit software. |
| LogP |
1.54
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM165943
Similarity: 0.9677
Similarity to MM165943
| Tanimoto metric | 0.9677 |
|---|---|
| Cosine metric | 0.9837 |
| Dice metric | 0.9836 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM363590
Similarity: 0.8133
Similarity to MM363590
| Tanimoto metric | 0.8133 |
|---|---|
| Cosine metric | 0.9006 |
| Dice metric | 0.8971 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM112784
Similarity: 0.8065
Similarity to MM112784
| Tanimoto metric | 0.8065 |
|---|---|
| Cosine metric | 0.898 |
| Dice metric | 0.8929 |
| MW: | 112.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+502 more
