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DocumentationIdentifier: MM77083
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM77083 |
| SMILES |
CC(O)C(N)C(C)CF
|
| InChIKey |
VRCCGKUFDDHFMP-UHFFFAOYSA-N
|
| MW [Da] |
135.18
Automatically obtained from RDkit software. |
| LogP |
0.3
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM348153
Similarity: 0.803
Similarity to MM348153
| Tanimoto metric | 0.803 |
|---|---|
| Cosine metric | 0.8961 |
| Dice metric | 0.8908 |
| MW: | 153.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.25 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348151
Similarity: 0.7626
Similarity to MM348151
| Tanimoto metric | 0.7626 |
|---|---|
| Cosine metric | 0.8733 |
| Dice metric | 0.8653 |
| MW: | 151.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.73 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM348462
Similarity: 0.731
Similarity to MM348462
| Tanimoto metric | 0.731 |
|---|---|
| Cosine metric | 0.855 |
| Dice metric | 0.8446 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.09 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+435 more
