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DocumentationIdentifier: MM445091
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM445091 |
| SMILES |
CCN(C=O)CCC(C)=O
|
| InChIKey |
IUKRMXAOQFCKMO-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM444907
Similarity: 0.8018
Similarity to MM444907
| Tanimoto metric | 0.8018 |
|---|---|
| Cosine metric | 0.8922 |
| Dice metric | 0.89 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM24585
Similarity: 0.7103
Similarity to MM24585
| Tanimoto metric | 0.7103 |
|---|---|
| Cosine metric | 0.8307 |
| Dice metric | 0.8306 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM299120
Similarity: 0.6496
Similarity to MM299120
| Tanimoto metric | 0.6496 |
|---|---|
| Cosine metric | 0.7881 |
| Dice metric | 0.7876 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | |||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+68 more
