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DocumentationIdentifier: MM272745
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272745 |
| SMILES |
O=CC1NC1C(=O)CF
|
| InChIKey |
OMYBPXJXULERFQ-UHFFFAOYSA-N
|
| MW [Da] |
131.11
Automatically obtained from RDkit software. |
| LogP |
-0.94
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: 0.8412
Similarity to MM263172
| Tanimoto metric | 0.8412 |
|---|---|
| Cosine metric | 0.9172 |
| Dice metric | 0.9137 |
| MW: | 117.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM262793
Similarity: 0.7853
Similarity to MM262793
| Tanimoto metric | 0.7853 |
|---|---|
| Cosine metric | 0.8798 |
| Dice metric | 0.8798 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.28 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350823
Similarity: 0.6765
Similarity to MM350823
| Tanimoto metric | 0.6765 |
|---|---|
| Cosine metric | 0.8225 |
| Dice metric | 0.807 |
| MW: | 113.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.89 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+19 more
