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DocumentationIdentifier: MM274051
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM274051 |
| SMILES |
CC(F)=CC(C=O)NC=O
|
| InChIKey |
NOIIRRPRUJRGQE-UHFFFAOYSA-N
|
| MW [Da] |
145.13
Automatically obtained from RDkit software. |
| LogP |
0.17
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM178264
Similarity: 0.6866
Similarity to MM178264
| Tanimoto metric | 0.6866 |
|---|---|
| Cosine metric | 0.8286 |
| Dice metric | 0.8142 |
| MW: | 131.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM51393
Similarity: 0.6493
Similarity to MM51393
| Tanimoto metric | 0.6493 |
|---|---|
| Cosine metric | 0.8058 |
| Dice metric | 0.7873 |
| MW: | 127.14 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223363
Similarity: 0.6149
Similarity to MM223363
| Tanimoto metric | 0.6149 |
|---|---|
| Cosine metric | 0.7619 |
| Dice metric | 0.7615 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.38 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+41 more
