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DocumentationIdentifier: MM350179
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM350179 |
| SMILES |
O=C(NCCO)C(O)CO
|
| InChIKey |
RZPJQLUVIIOPQF-UHFFFAOYSA-N
|
| MW [Da] |
149.15
Automatically obtained from RDkit software. |
| LogP |
-2.55
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172954
Similarity: 0.8983
Similarity to MM172954
| Tanimoto metric | 0.8983 |
|---|---|
| Cosine metric | 0.9478 |
| Dice metric | 0.9464 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162415
Similarity: 0.7712
Similarity to MM162415
| Tanimoto metric | 0.7712 |
|---|---|
| Cosine metric | 0.8782 |
| Dice metric | 0.8708 |
| MW: | 133.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM350464
Similarity: 0.7681
Similarity to MM350464
| Tanimoto metric | 0.7681 |
|---|---|
| Cosine metric | 0.8693 |
| Dice metric | 0.8689 |
| MW: | 147.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+520 more
