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DocumentationIdentifier: MM180010
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM180010 |
| SMILES |
N#CC(NC=N)C(=N)N
|
| InChIKey |
BQNSAZMLLDGYAG-UHFFFAOYSA-N
|
| MW [Da] |
125.14
Automatically obtained from RDkit software. |
| LogP |
-0.99
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM394114
Similarity: 0.8359
Similarity to MM394114
| Tanimoto metric | 0.8359 |
|---|---|
| Cosine metric | 0.9143 |
| Dice metric | 0.9106 |
| MW: | 139.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM45537
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| Tanimoto metric | 0.7754 |
|---|---|
| Cosine metric | 0.8805 |
| Dice metric | 0.8735 |
| MW: | 139.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM38021
Similarity: 0.7181
Similarity to MM38021
| Tanimoto metric | 0.7181 |
|---|---|
| Cosine metric | 0.8474 |
| Dice metric | 0.8359 |
| MW: | 139.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+54 more
