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DocumentationIdentifier: MM224102
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM224102 |
| SMILES |
CCC(CF)CC(C)(C)F
|
| InChIKey |
LAVPWLVRKKGJCJ-UHFFFAOYSA-N
|
| MW [Da] |
150.21
Automatically obtained from RDkit software. |
| LogP |
3.12
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM226000
Similarity: 0.7677
Similarity to MM226000
| Tanimoto metric | 0.7677 |
|---|---|
| Cosine metric | 0.8687 |
| Dice metric | 0.8686 |
| MW: | 150.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 3.12 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM129980
Similarity: 0.7209
Similarity to MM129980
| Tanimoto metric | 0.7209 |
|---|---|
| Cosine metric | 0.8491 |
| Dice metric | 0.8378 |
| MW: | 132.22 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM224099
Similarity: 0.7111
Similarity to MM224099
| Tanimoto metric | 0.7111 |
|---|---|
| Cosine metric | 0.8369 |
| Dice metric | 0.8312 |
| MW: | 146.25 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 3.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+557 more
