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DocumentationIdentifier: MM256097
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM256097 |
| SMILES |
CCC(O)C(O)CC(=O)O
|
| InChIKey |
IMXCEUOMKHNTOT-UHFFFAOYSA-N
|
| MW [Da] |
148.16
Automatically obtained from RDkit software. |
| LogP |
-0.41
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM269485
Similarity: 0.6644
Similarity to MM269485
| Tanimoto metric | 0.6644 |
|---|---|
| Cosine metric | 0.8014 |
| Dice metric | 0.7984 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.63 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM445950
Similarity: 0.6599
Similarity to MM445950
| Tanimoto metric | 0.6599 |
|---|---|
| Cosine metric | 0.7983 |
| Dice metric | 0.7951 |
| MW: | 145.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254763
Similarity: 0.6563
Similarity to MM254763
| Tanimoto metric | 0.6563 |
|---|---|
| Cosine metric | 0.7933 |
| Dice metric | 0.7925 |
| MW: | 148.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | -0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+187 more
