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DocumentationIdentifier: MM70074
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM70074 |
| SMILES |
CCOCC(CNC)NC
|
| InChIKey |
KKUOMSJJDREAIK-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
-0.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM71553
Similarity: 0.7788
Similarity to MM71553
| Tanimoto metric | 0.7788 |
|---|---|
| Cosine metric | 0.8772 |
| Dice metric | 0.8757 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM402159
Similarity: 0.7524
Similarity to MM402159
| Tanimoto metric | 0.7524 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8587 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM72010
Similarity: 0.7043
Similarity to MM72010
| Tanimoto metric | 0.7043 |
|---|---|
| Cosine metric | 0.8265 |
| Dice metric | 0.8265 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+248 more
