Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM463192
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM463192 |
| SMILES |
C#CC#CC(=O)C(F)C=O
|
| InChIKey |
CNAAJGXKLFESSK-UHFFFAOYSA-N
|
| MW [Da] |
138.1
Automatically obtained from RDkit software. |
| LogP |
-0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM163708
Similarity: 0.7833
Similarity to MM163708
| Tanimoto metric | 0.7833 |
|---|---|
| Cosine metric | 0.8851 |
| Dice metric | 0.8785 |
| MW: | 124.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM294695
Similarity: 0.7176
Similarity to MM294695
| Tanimoto metric | 0.7176 |
|---|---|
| Cosine metric | 0.8374 |
| Dice metric | 0.8356 |
| MW: | 138.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM184322
Similarity: 0.7143
Similarity to MM184322
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8333 |
| Dice metric | 0.8333 |
| MW: | 146.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+26 more
