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DocumentationIdentifier: MM370421
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370421 |
| SMILES |
CN=CNCC=C(F)CF
|
| InChIKey |
MSKNFHSUFCOHRW-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
1.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171065
Similarity: 0.8571
Similarity to MM171065
| Tanimoto metric | 0.8571 |
|---|---|
| Cosine metric | 0.9258 |
| Dice metric | 0.9231 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324674
Similarity: 0.6903
Similarity to MM324674
| Tanimoto metric | 0.6903 |
|---|---|
| Cosine metric | 0.8177 |
| Dice metric | 0.8168 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM125937
Similarity: 0.5495
Similarity to MM125937
| Tanimoto metric | 0.5495 |
|---|---|
| Cosine metric | 0.7412 |
| Dice metric | 0.7092 |
| MW: | 116.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+324 more
