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DocumentationIdentifier: MM283040
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM283040 |
| SMILES |
C=C(C#CC=CF)NC=N
|
| InChIKey |
CFKPFHRMHWVVPC-UHFFFAOYSA-N
|
| MW [Da] |
138.15
Automatically obtained from RDkit software. |
| LogP |
1.18
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM90668
Similarity: 0.8085
Similarity to MM90668
| Tanimoto metric | 0.8085 |
|---|---|
| Cosine metric | 0.8992 |
| Dice metric | 0.8941 |
| MW: | 120.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM380737
Similarity: 0.7458
Similarity to MM380737
| Tanimoto metric | 0.7458 |
|---|---|
| Cosine metric | 0.8576 |
| Dice metric | 0.8544 |
| MW: | 138.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM283039
Similarity: 0.7037
Similarity to MM283039
| Tanimoto metric | 0.7037 |
|---|---|
| Cosine metric | 0.8263 |
| Dice metric | 0.8261 |
| MW: | 134.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+133 more
