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DocumentationIdentifier: MM360301
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM360301 |
| SMILES |
CC(=CCCF)CNC=N
|
| InChIKey |
NEMPVFIDSJIOQV-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
1.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM360297
Similarity: 0.7353
Similarity to MM360297
| Tanimoto metric | 0.7353 |
|---|---|
| Cosine metric | 0.8486 |
| Dice metric | 0.8475 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238360
Similarity: 0.7009
Similarity to MM238360
| Tanimoto metric | 0.7009 |
|---|---|
| Cosine metric | 0.8244 |
| Dice metric | 0.8242 |
| MW: | 140.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.79 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM360299
Similarity: 0.6818
Similarity to MM360299
| Tanimoto metric | 0.6818 |
|---|---|
| Cosine metric | 0.8108 |
| Dice metric | 0.8108 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+316 more
