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DocumentationIdentifier: MM305338
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM305338 |
| SMILES |
C=COC(CCF)C(N)=O
|
| InChIKey |
MINHQXQQQVUQCL-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
0.36
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM305336
Similarity: 0.6706
Similarity to MM305336
| Tanimoto metric | 0.6706 |
|---|---|
| Cosine metric | 0.8033 |
| Dice metric | 0.8028 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM75708
Similarity: 0.6333
Similarity to MM75708
| Tanimoto metric | 0.6333 |
|---|---|
| Cosine metric | 0.7755 |
| Dice metric | 0.7755 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM75690
Similarity: 0.6175
Similarity to MM75690
| Tanimoto metric | 0.6175 |
|---|---|
| Cosine metric | 0.7635 |
| Dice metric | 0.7635 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+119 more
