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DocumentationIdentifier: MM356836
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM356836 |
| SMILES |
C=CCNC(=N)CC=CF
|
| InChIKey |
KNHVBPVNHGYOCM-UHFFFAOYSA-N
|
| MW [Da] |
142.18
Automatically obtained from RDkit software. |
| LogP |
1.61
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM356606
Similarity: 0.7905
Similarity to MM356606
| Tanimoto metric | 0.7905 |
|---|---|
| Cosine metric | 0.883 |
| Dice metric | 0.883 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM156554
Similarity: 0.7895
Similarity to MM156554
| Tanimoto metric | 0.7895 |
|---|---|
| Cosine metric | 0.8885 |
| Dice metric | 0.8824 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253231
Similarity: 0.7636
Similarity to MM253231
| Tanimoto metric | 0.7636 |
|---|---|
| Cosine metric | 0.8662 |
| Dice metric | 0.866 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+389 more
