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DocumentationIdentifier: MM76494
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM76494 |
| SMILES |
CCC(C)C(N)C(O)CF
|
| InChIKey |
DNUZEUDTIQVWTE-UHFFFAOYSA-N
|
| MW [Da] |
149.21
Automatically obtained from RDkit software. |
| LogP |
0.69
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM159928
Similarity: 0.7407
Similarity to MM159928
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8511 |
| MW: | 135.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.3 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM159919
Similarity: 0.6889
Similarity to MM159919
| Tanimoto metric | 0.6889 |
|---|---|
| Cosine metric | 0.83 |
| Dice metric | 0.8158 |
| MW: | 131.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM297384
Similarity: 0.662
Similarity to MM297384
| Tanimoto metric | 0.662 |
|---|---|
| Cosine metric | 0.805 |
| Dice metric | 0.7966 |
| MW: | 145.25 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.13 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+233 more
