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DocumentationIdentifier: MM241903
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM241903 |
| SMILES |
CC(NC=N)C(C)(C)CF
|
| InChIKey |
WIYXZSZRMCKISX-UHFFFAOYSA-N
|
| MW [Da] |
146.21
Automatically obtained from RDkit software. |
| LogP |
1.57
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM352719
Similarity: 0.6929
Similarity to MM352719
| Tanimoto metric | 0.6929 |
|---|---|
| Cosine metric | 0.8188 |
| Dice metric | 0.8186 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375944
Similarity: 0.6331
Similarity to MM375944
| Tanimoto metric | 0.6331 |
|---|---|
| Cosine metric | 0.7757 |
| Dice metric | 0.7753 |
| MW: | 150.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132046
Similarity: 0.6182
Similarity to MM132046
| Tanimoto metric | 0.6182 |
|---|---|
| Cosine metric | 0.7862 |
| Dice metric | 0.764 |
| MW: | 128.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+142 more
