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DocumentationIdentifier: MM290441
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM290441 |
| SMILES |
CC(F)=COC=CCCO
|
| InChIKey |
ZFYRIBDLXYYXAZ-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171330
Similarity: 0.7
Similarity to MM171330
| Tanimoto metric | 0.7 |
|---|---|
| Cosine metric | 0.8239 |
| Dice metric | 0.8235 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM290440
Similarity: 0.6988
Similarity to MM290440
| Tanimoto metric | 0.6988 |
|---|---|
| Cosine metric | 0.8227 |
| Dice metric | 0.8227 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.7 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159514
Similarity: 0.6932
Similarity to MM159514
| Tanimoto metric | 0.6932 |
|---|---|
| Cosine metric | 0.8203 |
| Dice metric | 0.8188 |
| MW: | 132.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+469 more
