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DocumentationIdentifier: MM68920
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM68920 |
| SMILES |
CC#CC(COC)NC=N
|
| InChIKey |
WWRQKWRZRNMWGM-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.22
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178361
Similarity: 0.7692
Similarity to MM178361
| Tanimoto metric | 0.7692 |
|---|---|
| Cosine metric | 0.8771 |
| Dice metric | 0.8696 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM379724
Similarity: 0.687
Similarity to MM379724
| Tanimoto metric | 0.687 |
|---|---|
| Cosine metric | 0.8159 |
| Dice metric | 0.8145 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.04 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM68934
Similarity: 0.6765
Similarity to MM68934
| Tanimoto metric | 0.6765 |
|---|---|
| Cosine metric | 0.8073 |
| Dice metric | 0.807 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+164 more
