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DocumentationIdentifier: MM245859
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM245859 |
| SMILES |
C=CC(=N)NC(C)C(=N)N
|
| InChIKey |
UOOIBZUTKWEZDK-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.06
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM133740
Similarity: 0.7481
Similarity to MM133740
| Tanimoto metric | 0.7481 |
|---|---|
| Cosine metric | 0.865 |
| Dice metric | 0.8559 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM245688
Similarity: 0.6375
Similarity to MM245688
| Tanimoto metric | 0.6375 |
|---|---|
| Cosine metric | 0.779 |
| Dice metric | 0.7786 |
| MW: | 142.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM145127
Similarity: 0.6296
Similarity to MM145127
| Tanimoto metric | 0.6296 |
|---|---|
| Cosine metric | 0.7935 |
| Dice metric | 0.7727 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+15 more
