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DocumentationIdentifier: MM250517
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250517 |
| SMILES |
CNCC(C)OCC(C)N
|
| InChIKey |
FDVZLTBUDZIXPJ-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
MM315409
Similarity: 0.7938
Similarity to MM315409
| Tanimoto metric | 0.7938 |
|---|---|
| Cosine metric | 0.8851 |
| Dice metric | 0.8851 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291203
Similarity: 0.7263
Similarity to MM291203
| Tanimoto metric | 0.7263 |
|---|---|
| Cosine metric | 0.843 |
| Dice metric | 0.8415 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM291204
Similarity: 0.7191
Similarity to MM291204
| Tanimoto metric | 0.7191 |
|---|---|
| Cosine metric | 0.8446 |
| Dice metric | 0.8366 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+497 more
