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DocumentationIdentifier: MM281798
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM281798 |
| SMILES |
C=C(C=CNC=N)COC
|
| InChIKey |
WGLSBHZNGYOWCU-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.9
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM169885
Similarity: 0.8041
Similarity to MM169885
| Tanimoto metric | 0.8041 |
|---|---|
| Cosine metric | 0.8967 |
| Dice metric | 0.8914 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM96046
Similarity: 0.7156
Similarity to MM96046
| Tanimoto metric | 0.7156 |
|---|---|
| Cosine metric | 0.8348 |
| Dice metric | 0.8342 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM321895
Similarity: 0.6446
Similarity to MM321895
| Tanimoto metric | 0.6446 |
|---|---|
| Cosine metric | 0.7842 |
| Dice metric | 0.7839 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.59 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+271 more
