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DocumentationIdentifier: MM297401
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297401 |
| SMILES |
CC(C)N(C)C(=O)CC=O
|
| InChIKey |
QPFLTXCEJTVCOU-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
MM297256
Similarity: 0.7109
Similarity to MM297256
| Tanimoto metric | 0.7109 |
|---|---|
| Cosine metric | 0.8311 |
| Dice metric | 0.8311 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM253986
Similarity: 0.687
Similarity to MM253986
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8145 |
| Dice metric | 0.8145 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM71780
Similarity: 0.6746
Similarity to MM71780
| Tanimoto metric | 0.6746 |
|---|---|
| Cosine metric | 0.8064 |
| Dice metric | 0.8057 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+245 more
