Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM179744
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM179744 |
| SMILES |
C=CCC(C=O)C(F)F
|
| InChIKey |
MLFJZQGQRZQFPO-UHFFFAOYSA-N
|
| MW [Da] |
134.13
Automatically obtained from RDkit software. |
| LogP |
1.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM37576
Similarity: 0.7407
Similarity to MM37576
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8511 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM116955
Similarity: 0.7037
Similarity to MM116955
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8389 |
| Dice metric | 0.8261 |
| MW: | 122.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM108101
Similarity: 0.642
Similarity to MM108101
| Tanimoto metric | 0.642 |
|---|---|
| Cosine metric | 0.8012 |
| Dice metric | 0.782 |
| MW: | 120.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+459 more
