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DocumentationIdentifier: MM206697
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM206697 |
| SMILES |
CC(CO)CCCC(=O)O
|
| InChIKey |
IUTYINVUSMFSCH-UHFFFAOYSA-N
|
| MW [Da] |
146.19
Automatically obtained from RDkit software. |
| LogP |
0.87
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM220901
Similarity: 0.8095
Similarity to MM220901
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8975 |
| Dice metric | 0.8947 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244156
Similarity: 0.7765
Similarity to MM244156
| Tanimoto metric | 0.7765 |
|---|---|
| Cosine metric | 0.8765 |
| Dice metric | 0.8742 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM361608
Similarity: 0.7714
Similarity to MM361608
| Tanimoto metric | 0.7714 |
|---|---|
| Cosine metric | 0.8783 |
| Dice metric | 0.871 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.98 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+523 more
