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DocumentationIdentifier: MM363878
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM363878 |
| SMILES |
CCC(C=O)N(C)CC=O
|
| InChIKey |
HZVDKSKXURVQCR-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM432825
Similarity: 0.6641
Similarity to MM432825
| Tanimoto metric | 0.6641 |
|---|---|
| Cosine metric | 0.7998 |
| Dice metric | 0.7982 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400874
Similarity: 0.6612
Similarity to MM400874
| Tanimoto metric | 0.6612 |
|---|---|
| Cosine metric | 0.7961 |
| Dice metric | 0.796 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM46753
Similarity: 0.6373
Similarity to MM46753
| Tanimoto metric | 0.6373 |
|---|---|
| Cosine metric | 0.7983 |
| Dice metric | 0.7784 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+116 more
