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DocumentationIdentifier: MM244795
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244795 |
| SMILES |
CC(C)C(C)CN(C)C=O
|
| InChIKey |
YDVVMACPHMHUTN-UHFFFAOYSA-N
|
| MW [Da] |
143.23
Automatically obtained from RDkit software. |
| LogP |
1.37
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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MM141700
Similarity: 0.8452
Similarity to MM141700
| Tanimoto metric | 0.8452 |
|---|---|
| Cosine metric | 0.9194 |
| Dice metric | 0.9161 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326261
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| Tanimoto metric | 0.7717 |
|---|---|
| Cosine metric | 0.8716 |
| Dice metric | 0.8712 |
| MW: | 143.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM261561
Similarity: 0.7604
Similarity to MM261561
| Tanimoto metric | 0.7604 |
|---|---|
| Cosine metric | 0.8639 |
| Dice metric | 0.8639 |
| MW: | 144.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+486 more
