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DocumentationIdentifier: MM144642
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM144642 |
| SMILES |
N=C(CO)NCC(F)F
|
| InChIKey |
JLEQJTQXPFJGCX-UHFFFAOYSA-N
|
| MW [Da] |
138.12
Automatically obtained from RDkit software. |
| LogP |
-0.19
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM113056
Similarity: 0.7975
Similarity to MM113056
| Tanimoto metric | 0.7975 |
|---|---|
| Cosine metric | 0.893 |
| Dice metric | 0.8873 |
| MW: | 120.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224852
Similarity: 0.6752
Similarity to MM224852
| Tanimoto metric | 0.6752 |
|---|---|
| Cosine metric | 0.8217 |
| Dice metric | 0.8061 |
| MW: | 152.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM80080
Similarity: 0.5943
Similarity to MM80080
| Tanimoto metric | 0.5943 |
|---|---|
| Cosine metric | 0.7471 |
| Dice metric | 0.7456 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | -0.43 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+299 more
