Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM132955
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM132955 |
| SMILES |
CC(=O)C(C)(C)C(C)=O
|
| InChIKey |
SWGDHTSWHSSMLE-UHFFFAOYSA-N
|
| MW [Da] |
128.17
Automatically obtained from RDkit software. |
| LogP |
1.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM140025
Similarity: 0.8133
Similarity to MM140025
| Tanimoto metric | 0.8133 |
|---|---|
| Cosine metric | 0.8979 |
| Dice metric | 0.8971 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244529
Similarity: 0.8025
Similarity to MM244529
| Tanimoto metric | 0.8025 |
|---|---|
| Cosine metric | 0.8958 |
| Dice metric | 0.8904 |
| MW: | 142.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM103310
Similarity: 0.7692
Similarity to MM103310
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 114.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+161 more
