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DocumentationIdentifier: MM254571
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254571 |
| SMILES |
CC(C)C(F)CCC(=O)O
|
| InChIKey |
ZSWHTBQOEUPCSO-UHFFFAOYSA-N
|
| MW [Da] |
148.18
Automatically obtained from RDkit software. |
| LogP |
1.85
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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4-fluorohexanoic Acid
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Similarity to 4-fluorohexanoic Acid
| Tanimoto metric | 0.8081 |
|---|---|
| Cosine metric | 0.8989 |
| Dice metric | 0.8939 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250626
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Similarity to MM250626
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8206 |
| Dice metric | 0.8205 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.55 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM268444
Similarity: 0.6842
Similarity to MM268444
| Tanimoto metric | 0.6842 |
|---|---|
| Cosine metric | 0.818 |
| Dice metric | 0.8125 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+273 more
