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DocumentationIdentifier: MM254051
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254051 |
| SMILES |
C=C(F)C(O)C(=O)C(C)C
|
| InChIKey |
XOYMPXUOYSCMHQ-UHFFFAOYSA-N
|
| MW [Da] |
146.16
Automatically obtained from RDkit software. |
| LogP |
1.06
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: 0.7127
Similarity to MM297486
| Tanimoto metric | 0.7127 |
|---|---|
| Cosine metric | 0.8327 |
| Dice metric | 0.8323 |
| MW: | 150.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.76 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM297484
Similarity: 0.7005
Similarity to MM297484
| Tanimoto metric | 0.7005 |
|---|---|
| Cosine metric | 0.8239 |
| Dice metric | 0.8239 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM298039
Similarity: 0.6615
Similarity to MM298039
| Tanimoto metric | 0.6615 |
|---|---|
| Cosine metric | 0.7964 |
| Dice metric | 0.7963 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+91 more
