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DocumentationIdentifier: MM370168
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM370168 |
| SMILES |
N#CC(F)=CCCNC=N
|
| InChIKey |
ISONPRCRQGFBNC-UHFFFAOYSA-N
|
| MW [Da] |
141.15
Automatically obtained from RDkit software. |
| LogP |
0.95
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM154863
Similarity: 0.7526
Similarity to MM154863
| Tanimoto metric | 0.7526 |
|---|---|
| Cosine metric | 0.8675 |
| Dice metric | 0.8588 |
| MW: | 130.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.45 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM260499
Similarity: 0.6491
Similarity to MM260499
| Tanimoto metric | 0.6491 |
|---|---|
| Cosine metric | 0.7876 |
| Dice metric | 0.7872 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM324451
Similarity: 0.6183
Similarity to MM324451
| Tanimoto metric | 0.6183 |
|---|---|
| Cosine metric | 0.7669 |
| Dice metric | 0.7642 |
| MW: | 142.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+282 more
