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DocumentationIdentifier: MM392535
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM392535 |
| SMILES |
CC(F)C(C=O)CCCF
|
| InChIKey |
IJZGNQCZPBXVNS-UHFFFAOYSA-N
|
| MW [Da] |
150.17
Automatically obtained from RDkit software. |
| LogP |
1.91
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM392533
Similarity: 0.7963
Similarity to MM392533
| Tanimoto metric | 0.7963 |
|---|---|
| Cosine metric | 0.8866 |
| Dice metric | 0.8866 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM392636
Similarity: 0.789
Similarity to MM392636
| Tanimoto metric | 0.789 |
|---|---|
| Cosine metric | 0.8821 |
| Dice metric | 0.8821 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274972
Similarity: 0.7568
Similarity to MM274972
| Tanimoto metric | 0.7568 |
|---|---|
| Cosine metric | 0.8615 |
| Dice metric | 0.8615 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+286 more
