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DocumentationIdentifier: MM320178
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM320178 |
| SMILES |
O=CC(O)(C=O)C(O)CO
|
| InChIKey |
YISRPXDHUJCRAD-UHFFFAOYSA-N
|
| MW [Da] |
148.11
Automatically obtained from RDkit software. |
| LogP |
-2.53
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM137627
Similarity: 0.8492
Similarity to MM137627
| Tanimoto metric | 0.8492 |
|---|---|
| Cosine metric | 0.9215 |
| Dice metric | 0.9185 |
| MW: | 134.13 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM139940
Similarity: 0.746
Similarity to MM139940
| Tanimoto metric | 0.746 |
|---|---|
| Cosine metric | 0.8637 |
| Dice metric | 0.8545 |
| MW: | 132.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM242003
Similarity: 0.6859
Similarity to MM242003
| Tanimoto metric | 0.6859 |
|---|---|
| Cosine metric | 0.8144 |
| Dice metric | 0.8137 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.06 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
