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DocumentationIdentifier: MM220513
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM220513 |
| SMILES |
CC(C)(N)CCC(F)(F)F
|
| InChIKey |
SGBXFPDLALERHX-UHFFFAOYSA-N
|
| MW [Da] |
155.16
Automatically obtained from RDkit software. |
| LogP |
2.07
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM130360
Similarity: 0.7722
Similarity to MM130360
| Tanimoto metric | 0.7722 |
|---|---|
| Cosine metric | 0.8787 |
| Dice metric | 0.8714 |
| MW: | 141.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.68 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227743
Similarity: 0.6634
Similarity to MM227743
| Tanimoto metric | 0.6634 |
|---|---|
| Cosine metric | 0.799 |
| Dice metric | 0.7976 |
| MW: | 151.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.16 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM88352
Similarity: 0.6582
Similarity to MM88352
| Tanimoto metric | 0.6582 |
|---|---|
| Cosine metric | 0.8113 |
| Dice metric | 0.7939 |
| MW: | 119.18 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.47 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+627 more
