Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM246112
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246112 |
| SMILES |
CC(F)C(=O)CC(O)C=O
|
| InChIKey |
KACQMSUJZPWERV-UHFFFAOYSA-N
|
| MW [Da] |
148.13
Automatically obtained from RDkit software. |
| LogP |
-0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM40810
Similarity: 0.7612
Similarity to MM40810
| Tanimoto metric | 0.7612 |
|---|---|
| Cosine metric | 0.8725 |
| Dice metric | 0.8644 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM142220
Similarity: 0.6866
Similarity to MM142220
| Tanimoto metric | 0.6866 |
|---|---|
| Cosine metric | 0.8286 |
| Dice metric | 0.8142 |
| MW: | 134.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.53 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM269147
Similarity: 0.6645
Similarity to MM269147
| Tanimoto metric | 0.6645 |
|---|---|
| Cosine metric | 0.7991 |
| Dice metric | 0.7984 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+58 more
