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DocumentationIdentifier: MM274326
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274326 |
| SMILES |
NCC(=CC(F)F)CCF
|
| InChIKey |
NUOHTTYSZZCSSS-UHFFFAOYSA-N
|
| MW [Da] |
153.15
Automatically obtained from RDkit software. |
| LogP |
1.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM71806
Similarity: 0.8163
Similarity to MM71806
| Tanimoto metric | 0.8163 |
|---|---|
| Cosine metric | 0.9035 |
| Dice metric | 0.8989 |
| MW: | 135.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71857
Similarity: 0.8061
Similarity to MM71857
| Tanimoto metric | 0.8061 |
|---|---|
| Cosine metric | 0.8978 |
| Dice metric | 0.8927 |
| MW: | 135.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM274359
Similarity: 0.6838
Similarity to MM274359
| Tanimoto metric | 0.6838 |
|---|---|
| Cosine metric | 0.8122 |
| Dice metric | 0.8122 |
| MW: | 147.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+666 more
