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DocumentationIdentifier: MM263140
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM263140 |
| SMILES |
C=C(COC)NC(=N)CO
|
| InChIKey |
GGPFRTMRXXLUSM-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM142586
Similarity: 0.7917
Similarity to MM142586
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8837 |
| MW: | 130.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.95 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263139
Similarity: 0.66
Similarity to MM263139
| Tanimoto metric | 0.66 |
|---|---|
| Cosine metric | 0.7957 |
| Dice metric | 0.7952 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM89149
Similarity: 0.6591
Similarity to MM89149
| Tanimoto metric | 0.6591 |
|---|---|
| Cosine metric | 0.7982 |
| Dice metric | 0.7945 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+433 more
