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DocumentationIdentifier: MM111939
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM111939 |
| SMILES |
C=C(CN)N(C)C=N
|
| InChIKey |
GUTXUWGXDBHGNJ-UHFFFAOYSA-N
|
| MW [Da] |
113.16
Automatically obtained from RDkit software. |
| LogP | N/A |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
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MM173333
Similarity: 0.7978
Similarity to MM173333
| Tanimoto metric | 0.7978 |
|---|---|
| Cosine metric | 0.8932 |
| Dice metric | 0.8875 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM174190
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| Tanimoto metric | 0.7634 |
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| Cosine metric | 0.8738 |
| Dice metric | 0.8659 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.05 |
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|---|---|---|---|---|---|
| AI: | 0
Total active interactions
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MM98082
Similarity: 0.662
Similarity to MM98082
| Tanimoto metric | 0.662 |
|---|---|
| Cosine metric | 0.8136 |
| Dice metric | 0.7966 |
| MW: | 99.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.34 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+326 more
