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DocumentationIdentifier: MM345973
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM345973 |
| SMILES |
CCN(C=N)CC=C(C)F
|
| InChIKey |
CLCBIQCGMAVBFP-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.79
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM146350
Similarity: 0.7959
Similarity to MM146350
| Tanimoto metric | 0.7959 |
|---|---|
| Cosine metric | 0.8921 |
| Dice metric | 0.8864 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324674
Similarity: 0.65
Similarity to MM324674
| Tanimoto metric | 0.65 |
|---|---|
| Cosine metric | 0.7879 |
| Dice metric | 0.7879 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324672
Similarity: 0.6446
Similarity to MM324672
| Tanimoto metric | 0.6446 |
|---|---|
| Cosine metric | 0.784 |
| Dice metric | 0.7839 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+202 more
