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DocumentationIdentifier: MM24585
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM24585 |
| SMILES |
CCC(=O)CCN(C)C=O
|
| InChIKey |
CZBLGHOTEWFYPQ-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
MM300427
Similarity: 0.7444
Similarity to MM300427
| Tanimoto metric | 0.7444 |
|---|---|
| Cosine metric | 0.8628 |
| Dice metric | 0.8535 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM445091
Similarity: 0.7103
Similarity to MM445091
| 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
|
MM318136
Similarity: 0.6637
Similarity to MM318136
| Tanimoto metric | 0.6637 |
|---|---|
| Cosine metric | 0.7986 |
| Dice metric | 0.7979 |
| MW: | 141.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+68 more
