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DocumentationIdentifier: MM65856
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM65856 |
| SMILES |
CCN=CNC=COC
|
| InChIKey |
XYIZHWQPTNOGJX-UHFFFAOYSA-N
|
| MW [Da] |
128.18
Automatically obtained from RDkit software. |
| LogP |
0.74
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM69206
Similarity: 0.6857
Similarity to MM69206
| Tanimoto metric | 0.6857 |
|---|---|
| Cosine metric | 0.8146 |
| Dice metric | 0.8136 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM370718
Similarity: 0.6667
Similarity to MM370718
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM283867
Similarity: 0.6458
Similarity to MM283867
| Tanimoto metric | 0.6458 |
|---|---|
| Cosine metric | 0.8036 |
| Dice metric | 0.7848 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+365 more
