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DocumentationIdentifier: MM280286
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM280286 |
| SMILES |
C#CC=COC(=O)CCN
|
| InChIKey |
SYABCRQURLVWEP-UHFFFAOYSA-N
|
| MW [Da] |
139.15
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
MM168737
Similarity: 0.8039
Similarity to MM168737
| Tanimoto metric | 0.8039 |
|---|---|
| Cosine metric | 0.8966 |
| Dice metric | 0.8913 |
| MW: | 124.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253264
Similarity: 0.7241
Similarity to MM253264
| Tanimoto metric | 0.7241 |
|---|---|
| Cosine metric | 0.8402 |
| Dice metric | 0.84 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.8 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM280506
Similarity: 0.6949
Similarity to MM280506
| Tanimoto metric | 0.6949 |
|---|---|
| Cosine metric | 0.8202 |
| Dice metric | 0.82 |
| MW: | 136.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+268 more
