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DocumentationIdentifier: MM234379
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM234379 |
| SMILES |
CC(F)(C#CCF)CCO
|
| InChIKey |
LPKUSFKSJFVUGS-UHFFFAOYSA-N
|
| MW [Da] |
148.15
Automatically obtained from RDkit software. |
| LogP |
1.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM132503
Similarity: 0.8532
Similarity to MM132503
| Tanimoto metric | 0.8532 |
|---|---|
| Cosine metric | 0.9237 |
| Dice metric | 0.9208 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234378
Similarity: 0.7705
Similarity to MM234378
| Tanimoto metric | 0.7705 |
|---|---|
| Cosine metric | 0.8704 |
| Dice metric | 0.8704 |
| MW: | 146.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234405
Similarity: 0.7266
Similarity to MM234405
| Tanimoto metric | 0.7266 |
|---|---|
| Cosine metric | 0.8417 |
| Dice metric | 0.8416 |
| MW: | 140.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+535 more
