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DocumentationIdentifier: MM250736
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250736 |
| SMILES |
N#CCC(F)CCC(=O)O
|
| InChIKey |
BOKMVRFMSMJAEO-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
1.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
4-fluorohexanoic Acid
Similarity: 0.7692
Similarity to 4-fluorohexanoic Acid
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM236636
Similarity: 0.6935
Similarity to MM236636
| Tanimoto metric | 0.6935 |
|---|---|
| Cosine metric | 0.8191 |
| Dice metric | 0.819 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250626
Similarity: 0.6807
Similarity to MM250626
| Tanimoto metric | 0.6807 |
|---|---|
| Cosine metric | 0.8106 |
| Dice metric | 0.81 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+262 more
