Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM225743
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM225743 |
| SMILES |
CC(O)C(=O)C(C)(C)C=O
|
| InChIKey |
RBVIGSJOSYDLCW-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.16
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41675
Similarity: 0.656
Similarity to MM41675
| Tanimoto metric | 0.656 |
|---|---|
| Cosine metric | 0.8099 |
| Dice metric | 0.7923 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298359
Similarity: 0.5976
Similarity to MM298359
| Tanimoto metric | 0.5976 |
|---|---|
| Cosine metric | 0.7489 |
| Dice metric | 0.7481 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM351524
Similarity: 0.5939
Similarity to MM351524
| Tanimoto metric | 0.5939 |
|---|---|
| Cosine metric | 0.7462 |
| Dice metric | 0.7452 |
| MW: | 141.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+176 more
