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DocumentationIdentifier: MM250502
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250502 |
| SMILES |
CNCC(N)COC(C)C
|
| InChIKey |
AKQZQQZCYFYQNI-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
-0.04
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM78567
Similarity: 0.7849
Similarity to MM78567
| Tanimoto metric | 0.7849 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8795 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM144060
Similarity: 0.7816
Similarity to MM144060
| Tanimoto metric | 0.7816 |
|---|---|
| Cosine metric | 0.8841 |
| Dice metric | 0.8774 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM355364
Similarity: 0.73
Similarity to MM355364
| Tanimoto metric | 0.73 |
|---|---|
| Cosine metric | 0.8439 |
| Dice metric | 0.8439 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+356 more
