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DocumentationIdentifier: MM92024
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM92024 |
| SMILES |
C=CN(C=N)C(C)(C)CO
|
| InChIKey |
WVOKRZDNFUXAJW-UHFFFAOYSA-N
|
| MW [Da] |
142.2
Automatically obtained from RDkit software. |
| LogP |
0.81
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM197094
Similarity: 0.7705
Similarity to MM197094
| Tanimoto metric | 0.7705 |
|---|---|
| Cosine metric | 0.8778 |
| Dice metric | 0.8704 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.42 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM400656
Similarity: 0.7015
Similarity to MM400656
| Tanimoto metric | 0.7015 |
|---|---|
| Cosine metric | 0.8266 |
| Dice metric | 0.8246 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.61 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM379296
Similarity: 0.6438
Similarity to MM379296
| Tanimoto metric | 0.6438 |
|---|---|
| Cosine metric | 0.7834 |
| Dice metric | 0.7833 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+64 more
