Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM172527
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM172527 |
| SMILES |
N#CCC(F)C(=O)CF
|
| InChIKey |
IYVPDFNACLQOCX-UHFFFAOYSA-N
|
| MW [Da] |
133.1
Automatically obtained from RDkit software. |
| LogP |
0.78
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM298267
Similarity: 0.7642
Similarity to MM298267
| Tanimoto metric | 0.7642 |
|---|---|
| Cosine metric | 0.8742 |
| Dice metric | 0.8664 |
| MW: | 151.09 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.07 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM111728
Similarity: 0.7021
Similarity to MM111728
| Tanimoto metric | 0.7021 |
|---|---|
| Cosine metric | 0.8379 |
| Dice metric | 0.825 |
| MW: | 122.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.27 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM172524
Similarity: 0.6486
Similarity to MM172524
| Tanimoto metric | 0.6486 |
|---|---|
| Cosine metric | 0.7872 |
| Dice metric | 0.7869 |
| MW: | 129.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.22 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+199 more
