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DocumentationIdentifier: MM389455
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389455 |
| SMILES |
CCC(=O)C(CF)C(=N)N
|
| InChIKey |
MMDPEPHOYBKKSL-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM297458
Similarity: 0.6919
Similarity to MM297458
| Tanimoto metric | 0.6919 |
|---|---|
| Cosine metric | 0.8205 |
| Dice metric | 0.8179 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160494
Similarity: 0.6627
Similarity to MM160494
| Tanimoto metric | 0.6627 |
|---|---|
| Cosine metric | 0.8141 |
| Dice metric | 0.7972 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM308187
Similarity: 0.6373
Similarity to MM308187
| Tanimoto metric | 0.6373 |
|---|---|
| Cosine metric | 0.7785 |
| Dice metric | 0.7784 |
| MW: | 150.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+36 more
