Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM290162
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM290162 |
| SMILES |
CNCC#CC#CC(=N)N
|
| InChIKey |
UHVQAPUIGNYZAT-UHFFFAOYSA-N
|
| MW [Da] |
135.17
Automatically obtained from RDkit software. |
| LogP |
-0.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM69285
Similarity: 0.8667
Similarity to MM69285
| Tanimoto metric | 0.8667 |
|---|---|
| Cosine metric | 0.9309 |
| Dice metric | 0.9286 |
| MW: | 135.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM65990
Similarity: 0.8154
Similarity to MM65990
| Tanimoto metric | 0.8154 |
|---|---|
| Cosine metric | 0.903 |
| Dice metric | 0.8983 |
| MW: | 121.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM170877
Similarity: 0.8133
Similarity to MM170877
| Tanimoto metric | 0.8133 |
|---|---|
| Cosine metric | 0.8979 |
| Dice metric | 0.8971 |
| MW: | 120.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+194 more
