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DocumentationIdentifier: MM333302
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM333302 |
| SMILES |
CC=C(CO)NC(=N)CN
|
| InChIKey |
ZGLJOYQQIZPHGK-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
-0.59
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM273587
Similarity: 0.6524
Similarity to MM273587
| Tanimoto metric | 0.6524 |
|---|---|
| Cosine metric | 0.7901 |
| Dice metric | 0.7897 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273698
Similarity: 0.6446
Similarity to MM273698
| Tanimoto metric | 0.6446 |
|---|---|
| Cosine metric | 0.7841 |
| Dice metric | 0.7839 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273764
Similarity: 0.6331
Similarity to MM273764
| Tanimoto metric | 0.6331 |
|---|---|
| Cosine metric | 0.7754 |
| Dice metric | 0.7754 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+321 more
