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DocumentationIdentifier: MM273996
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM273996 |
| SMILES |
NCC(C=C(F)F)OC=O
|
| InChIKey |
QZZZVKFYJGYAHJ-UHFFFAOYSA-N
|
| MW [Da] |
151.11
Automatically obtained from RDkit software. |
| LogP |
0.27
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM136193
Similarity: 0.6957
Similarity to MM136193
| Tanimoto metric | 0.6957 |
|---|---|
| Cosine metric | 0.8341 |
| Dice metric | 0.8205 |
| MW: | 136.1 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.33 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM272779
Similarity: 0.6184
Similarity to MM272779
| Tanimoto metric | 0.6184 |
|---|---|
| Cosine metric | 0.7658 |
| Dice metric | 0.7642 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM273994
Similarity: 0.6154
Similarity to MM273994
| Tanimoto metric | 0.6154 |
|---|---|
| Cosine metric | 0.7648 |
| Dice metric | 0.7619 |
| MW: | 147.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.36 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+111 more
