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DocumentationIdentifier: MM263122
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263122 |
| SMILES |
C=C(CO)NC(=O)CCF
|
| InChIKey |
XTDMSPQUARRVBT-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.03
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM135524
Similarity: 0.7597
Similarity to MM135524
| Tanimoto metric | 0.7597 |
|---|---|
| Cosine metric | 0.8716 |
| Dice metric | 0.8634 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM65024
Similarity: 0.702
Similarity to MM65024
| Tanimoto metric | 0.702 |
|---|---|
| Cosine metric | 0.8249 |
| Dice metric | 0.8249 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263121
Similarity: 0.6954
Similarity to MM263121
| Tanimoto metric | 0.6954 |
|---|---|
| Cosine metric | 0.8203 |
| Dice metric | 0.8203 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+534 more
