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DocumentationIdentifier: MM70675
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM70675 |
| SMILES |
C#CC(=O)C(OC)C(=N)N
|
| InChIKey |
FTNFOPDCMVORDI-UHFFFAOYSA-N
|
| MW [Da] |
140.14
Automatically obtained from RDkit software. |
| LogP |
-0.86
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM71910
Similarity: 0.7216
Similarity to MM71910
| Tanimoto metric | 0.7216 |
|---|---|
| Cosine metric | 0.8495 |
| Dice metric | 0.8383 |
| MW: | 126.12 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM300087
Similarity: 0.6195
Similarity to MM300087
| Tanimoto metric | 0.6195 |
|---|---|
| Cosine metric | 0.7664 |
| Dice metric | 0.765 |
| MW: | 140.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM389495
Similarity: 0.6154
Similarity to MM389495
| Tanimoto metric | 0.6154 |
|---|---|
| Cosine metric | 0.7622 |
| Dice metric | 0.7619 |
| MW: | 146.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+30 more
