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DocumentationIdentifier: MM265020
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265020 |
| SMILES |
CN(CC#N)CC(F)=CF
|
| InChIKey |
LAIWZVKGVYLCLA-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
1.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM167860
Similarity: 0.7064
Similarity to MM167860
| Tanimoto metric | 0.7064 |
|---|---|
| Cosine metric | 0.8405 |
| Dice metric | 0.828 |
| MW: | 132.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM265018
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| Tanimoto metric | 0.6589 |
|---|---|
| Cosine metric | 0.7945 |
| Dice metric | 0.7944 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM248373
Similarity: 0.6434
Similarity to MM248373
| Tanimoto metric | 0.6434 |
|---|---|
| Cosine metric | 0.7833 |
| Dice metric | 0.783 |
| MW: | 153.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+74 more
