Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM102580
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM102580 |
| SMILES |
CC(C)(F)C(F)C#N
|
| InChIKey |
MAOIOYZLSPMSCL-UHFFFAOYSA-N
|
| MW [Da] |
119.11
Automatically obtained from RDkit software. |
| LogP |
1.6
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM103290
Similarity: 0.7531
Similarity to MM103290
| Tanimoto metric | 0.7531 |
|---|---|
| Cosine metric | 0.8605 |
| Dice metric | 0.8592 |
| MW: | 119.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.6 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM98437
Similarity: 0.6567
Similarity to MM98437
| Tanimoto metric | 0.6567 |
|---|---|
| Cosine metric | 0.8104 |
| Dice metric | 0.7928 |
| MW: | 105.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM26998
Similarity: 0.6269
Similarity to MM26998
| Tanimoto metric | 0.6269 |
|---|---|
| Cosine metric | 0.7917 |
| Dice metric | 0.7706 |
| MW: | 101.12 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.5 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+201 more
