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DocumentationIdentifier: MM406440
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406440 |
| SMILES |
COCC(N)C(CO)CO
|
| InChIKey |
UGHWIUCPNCIPGL-UHFFFAOYSA-N
|
| MW [Da] |
149.19
Automatically obtained from RDkit software. |
| LogP |
-1.44
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM292616
Similarity: 0.7885
Similarity to MM292616
| Tanimoto metric | 0.7885 |
|---|---|
| Cosine metric | 0.8818 |
| Dice metric | 0.8817 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM375710
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Similarity to MM375710
| Tanimoto metric | 0.7706 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.8705 |
| MW: | 149.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.44 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM361929
Similarity: 0.7593
Similarity to MM361929
| Tanimoto metric | 0.7593 |
|---|---|
| Cosine metric | 0.8636 |
| Dice metric | 0.8632 |
| MW: | 147.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+319 more
