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DocumentationIdentifier: MM88207
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM88207 |
| SMILES |
C=C(C)N(C=N)C(=C)C
|
| InChIKey |
ZXSJVQRCMNBSAW-UHFFFAOYSA-N
|
| MW [Da] |
124.19
Automatically obtained from RDkit software. |
| LogP |
1.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM389778
Similarity: 0.6378
Similarity to MM389778
| Tanimoto metric | 0.6378 |
|---|---|
| Cosine metric | 0.7986 |
| Dice metric | 0.7788 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM89236
Similarity: 0.6226
Similarity to MM89236
| Tanimoto metric | 0.6226 |
|---|---|
| Cosine metric | 0.7687 |
| Dice metric | 0.7674 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.96 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM83947
Similarity: 0.6183
Similarity to MM83947
| Tanimoto metric | 0.6183 |
|---|---|
| Cosine metric | 0.7863 |
| Dice metric | 0.7642 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.94 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+193 more
