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DocumentationIdentifier: MM254042
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254042 |
| SMILES |
C=C(C)C(C)C(=O)C(F)F
|
| InChIKey |
NNXVACABZRJKNV-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
2.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM160492
Similarity: 0.7857
Similarity to MM160492
| Tanimoto metric | 0.7857 |
|---|---|
| Cosine metric | 0.8864 |
| Dice metric | 0.88 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350030
Similarity: 0.6707
Similarity to MM350030
| Tanimoto metric | 0.6707 |
|---|---|
| Cosine metric | 0.8029 |
| Dice metric | 0.8029 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389751
Similarity: 0.6647
Similarity to MM389751
| Tanimoto metric | 0.6647 |
|---|---|
| Cosine metric | 0.7986 |
| Dice metric | 0.7986 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+122 more
