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DocumentationIdentifier: MM308399
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM308399 |
| SMILES |
O=CC(F)(CO)CCCO
|
| InChIKey |
PIQLNPOTIALXFR-UHFFFAOYSA-N
|
| MW [Da] |
150.15
Automatically obtained from RDkit software. |
| LogP |
-0.34
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM308650
Similarity: 0.8014
Similarity to MM308650
| Tanimoto metric | 0.8014 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8898 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.14 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM41867
Similarity: 0.6929
Similarity to MM41867
| Tanimoto metric | 0.6929 |
|---|---|
| Cosine metric | 0.8324 |
| Dice metric | 0.8186 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308652
Similarity: 0.6903
Similarity to MM308652
| Tanimoto metric | 0.6903 |
|---|---|
| Cosine metric | 0.8172 |
| Dice metric | 0.8168 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+239 more
