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DocumentationIdentifier: MM262793
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM262793 |
| SMILES |
CCC1NC1C(=O)CF
|
| InChIKey |
BCPOVZSNRCRWDU-UHFFFAOYSA-N
|
| MW [Da] |
131.15
Automatically obtained from RDkit software. |
| LogP |
0.28
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM263172
Similarity: 0.8363
Similarity to MM263172
| Tanimoto metric | 0.8363 |
|---|---|
| Cosine metric | 0.9145 |
| Dice metric | 0.9108 |
| MW: | 117.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272745
Similarity: 0.7853
Similarity to MM272745
| Tanimoto metric | 0.7853 |
|---|---|
| Cosine metric | 0.8798 |
| Dice metric | 0.8798 |
| MW: | 131.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389542
Similarity: 0.6667
Similarity to MM389542
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 113.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+117 more
