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DocumentationIdentifier: MM297782
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297782 |
| SMILES |
N#CCC(=O)C(O)C(=N)N
|
| InChIKey |
ZKCLEZFJMHZFIY-UHFFFAOYSA-N
|
| MW [Da] |
141.13
Automatically obtained from RDkit software. |
| LogP |
-1.23
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM297476
Similarity: 0.6788
Similarity to MM297476
| Tanimoto metric | 0.6788 |
|---|---|
| Cosine metric | 0.8089 |
| Dice metric | 0.8086 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297478
Similarity: 0.6701
Similarity to MM297478
| Tanimoto metric | 0.6701 |
|---|---|
| Cosine metric | 0.8027 |
| Dice metric | 0.8025 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.77 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297780
Similarity: 0.6583
Similarity to MM297780
| Tanimoto metric | 0.6583 |
|---|---|
| Cosine metric | 0.794 |
| Dice metric | 0.7939 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+42 more
