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DocumentationIdentifier: MM91935
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM91935 |
| SMILES |
C#CC(C)(C=NN)C(=N)N
|
| InChIKey |
VGLODAUCGXXIIR-UHFFFAOYSA-N
|
| MW [Da] |
138.17
Automatically obtained from RDkit software. |
| LogP |
-0.49
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180237
Similarity: 0.7405
Similarity to MM180237
| Tanimoto metric | 0.7405 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8509 |
| MW: | 124.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.88 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM91793
Similarity: 0.6382
Similarity to MM91793
| Tanimoto metric | 0.6382 |
|---|---|
| Cosine metric | 0.7802 |
| Dice metric | 0.7791 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM90742
Similarity: 0.62
Similarity to MM90742
| Tanimoto metric | 0.62 |
|---|---|
| Cosine metric | 0.7678 |
| Dice metric | 0.7654 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+121 more
