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DocumentationIdentifier: MM356522
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM356522 |
| SMILES |
N=C(CCCN)NC=CF
|
| InChIKey |
QUBWRYKIUKVJJW-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
0.73
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156844
Similarity: 0.8866
Similarity to MM156844
| Tanimoto metric | 0.8866 |
|---|---|
| Cosine metric | 0.9416 |
| Dice metric | 0.9399 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356742
Similarity: 0.7768
Similarity to MM356742
| Tanimoto metric | 0.7768 |
|---|---|
| Cosine metric | 0.8746 |
| Dice metric | 0.8744 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM356518
Similarity: 0.7748
Similarity to MM356518
| Tanimoto metric | 0.7748 |
|---|---|
| Cosine metric | 0.8732 |
| Dice metric | 0.8731 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+354 more
