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DocumentationIdentifier: MM394090
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM394090 |
| SMILES |
C=CC(CC=CC)C(=N)N
|
| InChIKey |
BFOSHKOPUPUAGR-UHFFFAOYSA-N
|
| MW [Da] |
138.21
Automatically obtained from RDkit software. |
| LogP |
1.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM180003
Similarity: 0.8407
Similarity to MM180003
| Tanimoto metric | 0.8407 |
|---|---|
| Cosine metric | 0.9169 |
| Dice metric | 0.9135 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305756
Similarity: 0.7803
Similarity to MM305756
| Tanimoto metric | 0.7803 |
|---|---|
| Cosine metric | 0.8772 |
| Dice metric | 0.8766 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM162845
Similarity: 0.7168
Similarity to MM162845
| Tanimoto metric | 0.7168 |
|---|---|
| Cosine metric | 0.8466 |
| Dice metric | 0.8351 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+351 more
