Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM156675
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM156675 |
| SMILES |
C#CCCC(=O)CC#C
|
| InChIKey |
CLBQXAWVPMGMBF-UHFFFAOYSA-N
|
| MW [Da] |
120.15
Automatically obtained from RDkit software. |
| LogP |
0.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM107432
Similarity: 0.8889
Similarity to MM107432
| Tanimoto metric | 0.8889 |
|---|---|
| Cosine metric | 0.9428 |
| Dice metric | 0.9412 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113276
Similarity: 0.8519
Similarity to MM113276
| Tanimoto metric | 0.8519 |
|---|---|
| Cosine metric | 0.923 |
| Dice metric | 0.92 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156343
Similarity: 0.7667
Similarity to MM156343
| Tanimoto metric | 0.7667 |
|---|---|
| Cosine metric | 0.8681 |
| Dice metric | 0.8679 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+438 more
