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DocumentationIdentifier: MM297484
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297484 |
| SMILES |
C=C(F)C(O)C(=O)CCO
|
| InChIKey |
KVYUIMKLZJTYGP-UHFFFAOYSA-N
|
| MW [Da] |
148.13
Automatically obtained from RDkit software. |
| LogP |
-0.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM297486
Similarity: 0.7207
Similarity to MM297486
| Tanimoto metric | 0.7207 |
|---|---|
| Cosine metric | 0.8379 |
| Dice metric | 0.8377 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254051
Similarity: 0.7005
Similarity to MM254051
| Tanimoto metric | 0.7005 |
|---|---|
| Cosine metric | 0.8239 |
| Dice metric | 0.8239 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM298039
Similarity: 0.6684
Similarity to MM298039
| Tanimoto metric | 0.6684 |
|---|---|
| Cosine metric | 0.8014 |
| Dice metric | 0.8012 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
