Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM358165
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM358165 |
| SMILES |
CCC#CC(O)C(=O)CC
|
| InChIKey |
ZITRJNJBLGEXNI-UHFFFAOYSA-N
|
| MW [Da] |
140.18
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM174623
Similarity: 0.8938
Similarity to MM174623
| Tanimoto metric | 0.8938 |
|---|---|
| Cosine metric | 0.9454 |
| Dice metric | 0.9439 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM358167
Similarity: 0.8047
Similarity to MM358167
| Tanimoto metric | 0.8047 |
|---|---|
| Cosine metric | 0.892 |
| Dice metric | 0.8918 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM163574
Similarity: 0.7876
Similarity to MM163574
| Tanimoto metric | 0.7876 |
|---|---|
| Cosine metric | 0.8875 |
| Dice metric | 0.8812 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+279 more
