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DocumentationIdentifier: MM272347
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM272347 |
| SMILES |
CC(=N)NC(CF)CC=O
|
| InChIKey |
IXHJLHIIQZNYRA-UHFFFAOYSA-N
|
| MW [Da] |
146.17
Automatically obtained from RDkit software. |
| LogP |
0.5
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM149927
Similarity: 0.7661
Similarity to MM149927
| Tanimoto metric | 0.7661 |
|---|---|
| Cosine metric | 0.8753 |
| Dice metric | 0.8676 |
| MW: | 132.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.32 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM328635
Similarity: 0.6507
Similarity to MM328635
| Tanimoto metric | 0.6507 |
|---|---|
| Cosine metric | 0.7887 |
| Dice metric | 0.7884 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272346
Similarity: 0.6209
Similarity to MM272346
| Tanimoto metric | 0.6209 |
|---|---|
| Cosine metric | 0.7661 |
| Dice metric | 0.7661 |
| MW: | 144.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+52 more
