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DocumentationIdentifier: MM307794
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM307794 |
| SMILES |
CC(C)=C(NC=O)C(C)F
|
| InChIKey |
XNIBFFAEUXPHGK-UHFFFAOYSA-N
|
| MW [Da] |
145.18
Automatically obtained from RDkit software. |
| LogP |
1.38
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180855
Similarity: 0.6554
Similarity to MM180855
| Tanimoto metric | 0.6554 |
|---|---|
| Cosine metric | 0.8096 |
| Dice metric | 0.7918 |
| MW: | 131.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM306223
Similarity: 0.6536
Similarity to MM306223
| Tanimoto metric | 0.6536 |
|---|---|
| Cosine metric | 0.7905 |
| Dice metric | 0.7905 |
| MW: | 145.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM384947
Similarity: 0.5833
Similarity to MM384947
| Tanimoto metric | 0.5833 |
|---|---|
| Cosine metric | 0.7374 |
| Dice metric | 0.7368 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.39 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+93 more
