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DocumentationIdentifier: MM68325
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM68325 |
| SMILES |
CCC(C)OCC(N)CN
|
| InChIKey |
YCEHHSHFEHBWGB-UHFFFAOYSA-N
|
| MW [Da] |
146.23
Automatically obtained from RDkit software. |
| LogP |
0.09
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM144060
Similarity: 0.7907
Similarity to MM144060
| Tanimoto metric | 0.7907 |
|---|---|
| Cosine metric | 0.8892 |
| Dice metric | 0.8831 |
| MW: | 132.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM361998
Similarity: 0.7207
Similarity to MM361998
| Tanimoto metric | 0.7207 |
|---|---|
| Cosine metric | 0.8419 |
| Dice metric | 0.8377 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224699
Similarity: 0.701
Similarity to MM224699
| Tanimoto metric | 0.701 |
|---|---|
| Cosine metric | 0.825 |
| Dice metric | 0.8242 |
| MW: | 146.23 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+411 more
