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DocumentationIdentifier: MM275211
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM275211 |
| SMILES |
CCN(CC(C)O)C(C)=O
|
| InChIKey |
WWXNZXXWNHXZQY-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
0.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133663
Similarity: 0.8783
Similarity to MM133663
| Tanimoto metric | 0.8783 |
|---|---|
| Cosine metric | 0.9372 |
| Dice metric | 0.9352 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM75632
Similarity: 0.8305
Similarity to MM75632
| Tanimoto metric | 0.8305 |
|---|---|
| Cosine metric | 0.9093 |
| Dice metric | 0.9074 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM149781
Similarity: 0.7478
Similarity to MM149781
| Tanimoto metric | 0.7478 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8557 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.15 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+324 more
