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DocumentationIdentifier: MM171747
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM171747 |
| SMILES |
CCC(F)C(C)CCF
|
| InChIKey |
QNUJBLZZRYTQNP-UHFFFAOYSA-N
|
| MW [Da] |
136.19
Automatically obtained from RDkit software. |
| LogP |
2.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171793
Similarity: 0.7632
Similarity to MM171793
| Tanimoto metric | 0.7632 |
|---|---|
| Cosine metric | 0.8658 |
| Dice metric | 0.8657 |
| MW: | 136.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375675
Similarity: 0.7556
Similarity to MM375675
| Tanimoto metric | 0.7556 |
|---|---|
| Cosine metric | 0.8692 |
| Dice metric | 0.8608 |
| MW: | 154.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244595
Similarity: 0.7416
Similarity to MM244595
| Tanimoto metric | 0.7416 |
|---|---|
| Cosine metric | 0.8581 |
| Dice metric | 0.8516 |
| MW: | 150.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
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