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DocumentationIdentifier: MM15859
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM15859 |
| SMILES |
O=CCOC(C=O)CC=O
|
| InChIKey |
MGTABUKGTQYZMV-UHFFFAOYSA-N
|
| MW [Da] |
144.13
Automatically obtained from RDkit software. |
| LogP |
-0.64
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199006
Similarity: 0.8095
Similarity to MM199006
| Tanimoto metric | 0.8095 |
|---|---|
| Cosine metric | 0.8997 |
| Dice metric | 0.8947 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM15870
Similarity: 0.7429
Similarity to MM15870
| Tanimoto metric | 0.7429 |
|---|---|
| Cosine metric | 0.8553 |
| Dice metric | 0.8525 |
| MW: | 148.13 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM403535
Similarity: 0.734
Similarity to MM403535
| Tanimoto metric | 0.734 |
|---|---|
| Cosine metric | 0.847 |
| Dice metric | 0.8466 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+95 more
