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DocumentationIdentifier: MM362297
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM362297 |
| SMILES |
C=CCOC(C)C(N)CO
|
| InChIKey |
LFBAMLXCZJTBOX-UHFFFAOYSA-N
|
| MW [Da] |
145.2
Automatically obtained from RDkit software. |
| LogP |
-0.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM171885
Similarity: 0.8087
Similarity to MM171885
| Tanimoto metric | 0.8087 |
|---|---|
| Cosine metric | 0.8993 |
| Dice metric | 0.8942 |
| MW: | 133.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM55045
Similarity: 0.7323
Similarity to MM55045
| Tanimoto metric | 0.7323 |
|---|---|
| Cosine metric | 0.8463 |
| Dice metric | 0.8455 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM55052
Similarity: 0.6739
Similarity to MM55052
| Tanimoto metric | 0.6739 |
|---|---|
| Cosine metric | 0.8052 |
| Dice metric | 0.8052 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+327 more
