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DocumentationIdentifier: MM348255
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM348255 |
| SMILES |
CCC(C)C(F)C(C)CO
|
| InChIKey |
NSONCWLLANMWGH-UHFFFAOYSA-N
|
| MW [Da] |
148.22
Automatically obtained from RDkit software. |
| LogP |
2
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171796
Similarity: 0.7959
Similarity to MM171796
| Tanimoto metric | 0.7959 |
|---|---|
| Cosine metric | 0.8921 |
| Dice metric | 0.8864 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM84410
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Similarity to MM84410
| Tanimoto metric | 0.7429 |
|---|---|
| Cosine metric | 0.8546 |
| Dice metric | 0.8525 |
| MW: | 150.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.73 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM159960
Similarity: 0.7143
Similarity to MM159960
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8452 |
| Dice metric | 0.8333 |
| MW: | 134.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+420 more
