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DocumentationIdentifier: MM73382
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM73382 |
| SMILES |
CN=CNC(=CCF)CO
|
| InChIKey |
NXXVQCABYZNJOQ-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM418437
Similarity: 0.7023
Similarity to MM418437
| Tanimoto metric | 0.7023 |
|---|---|
| Cosine metric | 0.8265 |
| Dice metric | 0.8251 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM87067
Similarity: 0.6875
Similarity to MM87067
| Tanimoto metric | 0.6875 |
|---|---|
| Cosine metric | 0.8152 |
| Dice metric | 0.8148 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM382951
Similarity: 0.6642
Similarity to MM382951
| Tanimoto metric | 0.6642 |
|---|---|
| Cosine metric | 0.7987 |
| Dice metric | 0.7982 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+305 more
