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DocumentationIdentifier: MM25810
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM25810 |
| SMILES |
C=COC(=C)C(CO)NC
|
| InChIKey |
OCMGBNITRSUIHG-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
0.24
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197217
Similarity: 0.7926
Similarity to MM197217
| Tanimoto metric | 0.7926 |
|---|---|
| Cosine metric | 0.8903 |
| Dice metric | 0.8843 |
| MW: | 131.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173153
Similarity: 0.7185
Similarity to MM173153
| Tanimoto metric | 0.7185 |
|---|---|
| Cosine metric | 0.8477 |
| Dice metric | 0.8362 |
| MW: | 129.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM353466
Similarity: 0.6581
Similarity to MM353466
| Tanimoto metric | 0.6581 |
|---|---|
| Cosine metric | 0.7948 |
| Dice metric | 0.7938 |
| MW: | 141.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.66 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+97 more
