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DocumentationIdentifier: MM265862
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM265862 |
| SMILES |
CC(=CCO)NC(=N)CO
|
| InChIKey |
SRQSRKNFROJVGN-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
-0.56
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM88218
Similarity: 0.8468
Similarity to MM88218
| Tanimoto metric | 0.8468 |
|---|---|
| Cosine metric | 0.9202 |
| Dice metric | 0.917 |
| MW: | 128.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM94247
Similarity: 0.7192
Similarity to MM94247
| Tanimoto metric | 0.7192 |
|---|---|
| Cosine metric | 0.8367 |
| Dice metric | 0.8367 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.64 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM80624
Similarity: 0.7162
Similarity to MM80624
| Tanimoto metric | 0.7162 |
|---|---|
| Cosine metric | 0.8349 |
| Dice metric | 0.8346 |
| MW: | 138.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.08 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+376 more
