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DocumentationIdentifier: MM92376
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM92376 |
| SMILES |
C=C(CO)OC=CNC=O
|
| InChIKey |
VXDNKIOIYKFKID-UHFFFAOYSA-N
|
| MW [Da] |
143.14
Automatically obtained from RDkit software. |
| LogP |
-0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM153767
Similarity: 0.7753
Similarity to MM153767
| Tanimoto metric | 0.7753 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8734 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.75 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM373786
Similarity: 0.7048
Similarity to MM373786
| Tanimoto metric | 0.7048 |
|---|---|
| Cosine metric | 0.8268 |
| Dice metric | 0.8268 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.18 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM374230
Similarity: 0.6698
Similarity to MM374230
| Tanimoto metric | 0.6698 |
|---|---|
| Cosine metric | 0.8023 |
| Dice metric | 0.8023 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.92 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+172 more
