Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM221429
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM221429 |
| SMILES |
CC(=CC(C)(F)F)CC=O
|
| InChIKey |
HTAADWRXYGGFNA-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM136401
Similarity: 0.7664
Similarity to MM136401
| Tanimoto metric | 0.7664 |
|---|---|
| Cosine metric | 0.8754 |
| Dice metric | 0.8677 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM130283
Similarity: 0.7383
Similarity to MM130283
| Tanimoto metric | 0.7383 |
|---|---|
| Cosine metric | 0.8593 |
| Dice metric | 0.8495 |
| MW: | 134.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224473
Similarity: 0.6957
Similarity to MM224473
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8244 |
| Dice metric | 0.8205 |
| MW: | 148.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+349 more
