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DocumentationIdentifier: MM265610
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265610 |
| SMILES |
CCC=C(C)CN(C)C=O
|
| InChIKey |
NRWDDISLCIZQEX-UHFFFAOYSA-N
|
| MW [Da] |
141.21
Automatically obtained from RDkit software. |
| LogP |
1.43
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM142997
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Similarity to MM142997
| Tanimoto metric | 0.8252 |
|---|---|
| Cosine metric | 0.9084 |
| Dice metric | 0.9043 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM248407
Similarity: 0.7328
Similarity to MM248407
| Tanimoto metric | 0.7328 |
|---|---|
| Cosine metric | 0.846 |
| Dice metric | 0.8458 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM25031
Similarity: 0.7049
Similarity to MM25031
| Tanimoto metric | 0.7049 |
|---|---|
| Cosine metric | 0.827 |
| Dice metric | 0.8269 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.54 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+295 more
