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DocumentationIdentifier: MM244523
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244523 |
| SMILES |
C=CC(C)(C(=C)C)C(=N)N
|
| InChIKey |
DKSANBJSDQEONH-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
MM132951
Similarity: 0.7517
Similarity to MM132951
| Tanimoto metric | 0.7517 |
|---|---|
| Cosine metric | 0.867 |
| Dice metric | 0.8582 |
| MW: | 126.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM181100
Similarity: 0.7383
Similarity to MM181100
| Tanimoto metric | 0.7383 |
|---|---|
| Cosine metric | 0.8592 |
| Dice metric | 0.8494 |
| MW: | 124.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM234857
Similarity: 0.612
Similarity to MM234857
| Tanimoto metric | 0.612 |
|---|---|
| Cosine metric | 0.7594 |
| Dice metric | 0.7593 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+60 more
