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DocumentationIdentifier: MM327001
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM327001 |
| SMILES |
O=CC(O)CC(C=O)CO
|
| InChIKey |
WLDAHZNKMWIPRX-UHFFFAOYSA-N
|
| MW [Da] |
146.14
Automatically obtained from RDkit software. |
| LogP |
-1.26
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM141818
Similarity: 0.6923
Similarity to MM141818
| Tanimoto metric | 0.6923 |
|---|---|
| Cosine metric | 0.8321 |
| Dice metric | 0.8182 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224161
Similarity: 0.6911
Similarity to MM224161
| Tanimoto metric | 0.6911 |
|---|---|
| Cosine metric | 0.8173 |
| Dice metric | 0.8173 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM326603
Similarity: 0.6694
Similarity to MM326603
| Tanimoto metric | 0.6694 |
|---|---|
| Cosine metric | 0.8019 |
| Dice metric | 0.8019 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.05 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+308 more
