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DocumentationIdentifier: MM333392
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM333392 |
| SMILES |
C=C(CN)NC(CO)=NC
|
| InChIKey |
ABZJNOMRQXIEKY-UHFFFAOYSA-N
|
| MW [Da] |
143.19
Automatically obtained from RDkit software. |
| LogP |
-0.93
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM82425
Similarity: 0.7676
Similarity to MM82425
| Tanimoto metric | 0.7676 |
|---|---|
| Cosine metric | 0.8761 |
| Dice metric | 0.8685 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM333394
Similarity: 0.6606
Similarity to MM333394
| Tanimoto metric | 0.6606 |
|---|---|
| Cosine metric | 0.7962 |
| Dice metric | 0.7956 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM263131
Similarity: 0.6584
Similarity to MM263131
| Tanimoto metric | 0.6584 |
|---|---|
| Cosine metric | 0.7956 |
| Dice metric | 0.794 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.72 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+226 more
