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DocumentationIdentifier: MM272461
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272461 |
| SMILES |
C=CC(CNC)NC(C)=N
|
| InChIKey |
SVKKCWGXKWYLMT-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.35
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM150022
Similarity: 0.7983
Similarity to MM150022
| Tanimoto metric | 0.7983 |
|---|---|
| Cosine metric | 0.8935 |
| Dice metric | 0.8879 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329301
Similarity: 0.6853
Similarity to MM329301
| Tanimoto metric | 0.6853 |
|---|---|
| Cosine metric | 0.8133 |
| Dice metric | 0.8133 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM329709
Similarity: 0.6786
Similarity to MM329709
| Tanimoto metric | 0.6786 |
|---|---|
| Cosine metric | 0.8086 |
| Dice metric | 0.8085 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+123 more
