Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM261089
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM261089 |
| SMILES |
C#CC(C)=CC#CC(=N)N
|
| InChIKey |
PPNUCMWDMADBKF-UHFFFAOYSA-N
|
| MW [Da] |
132.17
Automatically obtained from RDkit software. |
| LogP |
0.51
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM80956
Similarity: 0.7955
Similarity to MM80956
| Tanimoto metric | 0.7955 |
|---|---|
| Cosine metric | 0.8919 |
| Dice metric | 0.8861 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253149
Similarity: 0.7455
Similarity to MM253149
| Tanimoto metric | 0.7455 |
|---|---|
| Cosine metric | 0.8571 |
| Dice metric | 0.8542 |
| MW: | 132.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM79816
Similarity: 0.7273
Similarity to MM79816
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 118.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+279 more
