Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM221838
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221838 |
| SMILES |
CC(=O)CC(C)(F)CC=O
|
| InChIKey |
UCDCTIKDLHDYGC-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130757
Similarity: 0.8654
Similarity to MM130757
| Tanimoto metric | 0.8654 |
|---|---|
| Cosine metric | 0.9303 |
| Dice metric | 0.9278 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM229264
Similarity: 0.8108
Similarity to MM229264
| Tanimoto metric | 0.8108 |
|---|---|
| Cosine metric | 0.8961 |
| Dice metric | 0.8955 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132360
Similarity: 0.7404
Similarity to MM132360
| Tanimoto metric | 0.7404 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8508 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+161 more
