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DocumentationIdentifier: MM389429
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM389429 |
| SMILES |
C=C(CN)C(CC)C(=N)N
|
| InChIKey |
JZNLMPFXIOAREG-UHFFFAOYSA-N
|
| MW [Da] |
141.22
Automatically obtained from RDkit software. |
| LogP |
0.46
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM306974
Similarity: 0.8217
Similarity to MM306974
| Tanimoto metric | 0.8217 |
|---|---|
| Cosine metric | 0.9022 |
| Dice metric | 0.9021 |
| MW: | 141.22 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160480
Similarity: 0.7586
Similarity to MM160480
| Tanimoto metric | 0.7586 |
|---|---|
| Cosine metric | 0.871 |
| Dice metric | 0.8627 |
| MW: | 127.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389741
Similarity: 0.6919
Similarity to MM389741
| Tanimoto metric | 0.6919 |
|---|---|
| Cosine metric | 0.8179 |
| Dice metric | 0.8179 |
| MW: | 139.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+108 more
