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DocumentationIdentifier: MM238173
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM238173 |
| SMILES |
O=CCNC(=O)C=C(F)F
|
| InChIKey |
JANPVPQSSOSVGO-UHFFFAOYSA-N
|
| MW [Da] |
149.1
Automatically obtained from RDkit software. |
| LogP |
0.08
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM157324
Similarity: 0.8438
Similarity to MM157324
| Tanimoto metric | 0.8438 |
|---|---|
| Cosine metric | 0.9186 |
| Dice metric | 0.9153 |
| MW: | 131.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM238172
Similarity: 0.7642
Similarity to MM238172
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8666 |
| Dice metric | 0.8663 |
| MW: | 147.12 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM223388
Similarity: 0.7232
Similarity to MM223388
| Tanimoto metric | 0.7232 |
|---|---|
| Cosine metric | 0.8394 |
| Dice metric | 0.8394 |
| MW: | 149.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.29 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+321 more
