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DocumentationIdentifier: MM62911
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM62911 |
| SMILES |
CCCC(=O)OCC(N)=O
|
| InChIKey |
XBCPYUUUGVXLEY-UHFFFAOYSA-N
|
| MW [Da] |
145.16
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM156196
Similarity: 0.7273
Similarity to MM156196
| Tanimoto metric | 0.7273 |
|---|---|
| Cosine metric | 0.8528 |
| Dice metric | 0.8421 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM255054
Similarity: 0.7087
Similarity to MM255054
| Tanimoto metric | 0.7087 |
|---|---|
| Cosine metric | 0.8296 |
| Dice metric | 0.8295 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM251165
Similarity: 0.7031
Similarity to MM251165
| Tanimoto metric | 0.7031 |
|---|---|
| Cosine metric | 0.8257 |
| Dice metric | 0.8257 |
| MW: | 147.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+247 more
