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DocumentationIdentifier: MM254474
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254474 |
| SMILES |
CC(C)C(N)CCC(F)F
|
| InChIKey |
NUWQNPUZNCEYCV-UHFFFAOYSA-N
|
| MW [Da] |
151.2
Automatically obtained from RDkit software. |
| LogP |
2.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM161928
Similarity: 0.8101
Similarity to MM161928
| Tanimoto metric | 0.8101 |
|---|---|
| Cosine metric | 0.9001 |
| Dice metric | 0.8951 |
| MW: | 133.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM143998
Similarity: 0.7722
Similarity to MM143998
| Tanimoto metric | 0.7722 |
|---|---|
| Cosine metric | 0.8787 |
| Dice metric | 0.8714 |
| MW: | 137.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM250471
Similarity: 0.6739
Similarity to MM250471
| Tanimoto metric | 0.6739 |
|---|---|
| Cosine metric | 0.8055 |
| Dice metric | 0.8052 |
| MW: | 152.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+542 more
