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DocumentationIdentifier: MM61658
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM61658 |
| SMILES |
CC(N=CN)C(=O)CCF
|
| InChIKey |
CXEMFRYPAXWWTF-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.29
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM40133
Similarity: 0.6938
Similarity to MM40133
| Tanimoto metric | 0.6938 |
|---|---|
| Cosine metric | 0.8212 |
| Dice metric | 0.8192 |
| MW: | 146.17 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM378290
Similarity: 0.6194
Similarity to MM378290
| Tanimoto metric | 0.6194 |
|---|---|
| Cosine metric | 0.7649 |
| Dice metric | 0.7649 |
| MW: | 142.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM61418
Similarity: 0.6129
Similarity to MM61418
| Tanimoto metric | 0.6129 |
|---|---|
| Cosine metric | 0.76 |
| Dice metric | 0.76 |
| MW: | 140.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+37 more
