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DocumentationIdentifier: MM292603
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM292603 |
| SMILES |
COCC(N)C(O)CCO
|
| InChIKey |
ASHGGRNHXJPJDY-UHFFFAOYSA-N
|
| MW [Da] |
149.19
Automatically obtained from RDkit software. |
| LogP |
-1.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM361841
Similarity: 0.8624
Similarity to MM361841
| Tanimoto metric | 0.8624 |
|---|---|
| Cosine metric | 0.9264 |
| Dice metric | 0.9261 |
| MW: | 149.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM171783
Similarity: 0.7404
Similarity to MM171783
| Tanimoto metric | 0.7404 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8508 |
| MW: | 135.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM54657
Similarity: 0.7377
Similarity to MM54657
| Tanimoto metric | 0.7377 |
|---|---|
| Cosine metric | 0.8492 |
| Dice metric | 0.8491 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+237 more
