Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM139410
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM139410 |
| SMILES |
O=CCC(F)(C=O)CO
|
| InChIKey |
VAUMLDNKTLUAKH-UHFFFAOYSA-N
|
| MW [Da] |
134.11
Automatically obtained from RDkit software. |
| LogP |
-0.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM35127
Similarity: 0.767
Similarity to MM35127
| Tanimoto metric | 0.767 |
|---|---|
| Cosine metric | 0.8758 |
| Dice metric | 0.8681 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM103002
Similarity: 0.6796
Similarity to MM103002
| Tanimoto metric | 0.6796 |
|---|---|
| Cosine metric | 0.8244 |
| Dice metric | 0.8092 |
| MW: | 120.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229381
Similarity: 0.6688
Similarity to MM229381
| Tanimoto metric | 0.6688 |
|---|---|
| Cosine metric | 0.8178 |
| Dice metric | 0.8016 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+113 more
