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DocumentationIdentifier: MM365303
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM365303 |
| SMILES |
C=C(CC)OCCOC=O
|
| InChIKey |
MZCFVWWROKXKEZ-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
1.1
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM364862
Similarity: 0.7765
Similarity to MM364862
| Tanimoto metric | 0.7765 |
|---|---|
| Cosine metric | 0.8765 |
| Dice metric | 0.8742 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM69455
Similarity: 0.7253
Similarity to MM69455
| Tanimoto metric | 0.7253 |
|---|---|
| Cosine metric | 0.8412 |
| Dice metric | 0.8408 |
| MW: | 146.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.55 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM113099
Similarity: 0.6914
Similarity to MM113099
| Tanimoto metric | 0.6914 |
|---|---|
| Cosine metric | 0.8315 |
| Dice metric | 0.8175 |
| MW: | 116.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+532 more
