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DocumentationIdentifier: MM376410
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376410 |
| SMILES |
C#CC(F)C(CO)NC=O
|
| InChIKey |
WPIQUCUZJOAWKT-UHFFFAOYSA-N
|
| MW [Da] |
145.13
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
MM172290
Similarity: 0.6859
Similarity to MM172290
| Tanimoto metric | 0.6859 |
|---|---|
| Cosine metric | 0.8282 |
| Dice metric | 0.8137 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM376411
Similarity: 0.586
Similarity to MM376411
| Tanimoto metric | 0.586 |
|---|---|
| Cosine metric | 0.7402 |
| Dice metric | 0.739 |
| MW: | 147.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM231972
Similarity: 0.5825
Similarity to MM231972
| Tanimoto metric | 0.5825 |
|---|---|
| Cosine metric | 0.7363 |
| Dice metric | 0.7362 |
| MW: | 149.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+61 more
