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DocumentationIdentifier: MM41138
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM41138 |
| SMILES |
C=C(OC)C(C#N)N(C)C
|
| InChIKey |
XFGOSINMKKKUCW-UHFFFAOYSA-N
|
| MW [Da] |
140.19
Automatically obtained from RDkit software. |
| LogP |
0.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM41425
Similarity: 0.7947
Similarity to MM41425
| Tanimoto metric | 0.7947 |
|---|---|
| Cosine metric | 0.8915 |
| Dice metric | 0.8856 |
| MW: | 126.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.26 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM160410
Similarity: 0.6887
Similarity to MM160410
| Tanimoto metric | 0.6887 |
|---|---|
| Cosine metric | 0.8299 |
| Dice metric | 0.8157 |
| MW: | 129.2 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM408785
Similarity: 0.6742
Similarity to MM408785
| Tanimoto metric | 0.6742 |
|---|---|
| Cosine metric | 0.8054 |
| Dice metric | 0.8054 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.65 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+27 more
