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DocumentationIdentifier: MM246617
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM246617 |
| SMILES |
C=C(C)C(=O)CC(F)CC
|
| InChIKey |
GNVRFMYDEYBHCT-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133978
Similarity: 0.824
Similarity to MM133978
| Tanimoto metric | 0.824 |
|---|---|
| Cosine metric | 0.9077 |
| Dice metric | 0.9035 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM246693
Similarity: 0.7466
Similarity to MM246693
| Tanimoto metric | 0.7466 |
|---|---|
| Cosine metric | 0.8551 |
| Dice metric | 0.8549 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262193
Similarity: 0.7045
Similarity to MM262193
| Tanimoto metric | 0.7045 |
|---|---|
| Cosine metric | 0.8318 |
| Dice metric | 0.8267 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+435 more
