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DocumentationIdentifier: MM315573
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM315573 |
| SMILES |
N#CC(O)CCC(F)CF
|
| InChIKey |
IFVCJVOYDOCMFE-UHFFFAOYSA-N
|
| MW [Da] |
149.14
Automatically obtained from RDkit software. |
| LogP |
0.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144022
Similarity: 0.7273
Similarity to MM144022
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 138.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316001
Similarity: 0.6983
Similarity to MM316001
| Tanimoto metric | 0.6983 |
|---|---|
| Cosine metric | 0.8223 |
| Dice metric | 0.8223 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM315567
Similarity: 0.6864
Similarity to MM315567
| Tanimoto metric | 0.6864 |
|---|---|
| Cosine metric | 0.8141 |
| Dice metric | 0.8141 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+410 more
