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DocumentationIdentifier: MM184322
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM184322 |
| SMILES |
O=CC(F)C(=O)C#CCF
|
| InChIKey |
XXLSSXRVPWHSSM-UHFFFAOYSA-N
|
| MW [Da] |
146.09
Automatically obtained from RDkit software. |
| LogP |
0.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM463192
Similarity: 0.7143
Similarity to MM463192
| Tanimoto metric | 0.7143 |
|---|---|
| Cosine metric | 0.8333 |
| Dice metric | 0.8333 |
| MW: | 138.1 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM184057
Similarity: 0.7014
Similarity to MM184057
| Tanimoto metric | 0.7014 |
|---|---|
| Cosine metric | 0.8247 |
| Dice metric | 0.8245 |
| MW: | 144.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.91 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224974
Similarity: 0.6993
Similarity to MM224974
| Tanimoto metric | 0.6993 |
|---|---|
| Cosine metric | 0.8231 |
| Dice metric | 0.823 |
| MW: | 139.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+93 more
