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DocumentationIdentifier: MM376864
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM376864 |
| SMILES |
C=CCC(C=C)N(C)C=O
|
| InChIKey |
SFDSYYKCGQBKMV-UHFFFAOYSA-N
|
| MW [Da] |
139.2
Automatically obtained from RDkit software. |
| LogP |
1.21
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172207
Similarity: 0.7155
Similarity to MM172207
| Tanimoto metric | 0.7155 |
|---|---|
| Cosine metric | 0.8459 |
| Dice metric | 0.8342 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349752
Similarity: 0.6776
Similarity to MM349752
| Tanimoto metric | 0.6776 |
|---|---|
| Cosine metric | 0.8111 |
| Dice metric | 0.8078 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM388245
Similarity: 0.6691
Similarity to MM388245
| Tanimoto metric | 0.6691 |
|---|---|
| Cosine metric | 0.8017 |
| Dice metric | 0.8017 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+190 more
