Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM315539
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM315539 |
| SMILES |
N#CC(F)CCC(O)CO
|
| InChIKey |
GQBYEKMNTNQZTK-UHFFFAOYSA-N
|
| MW [Da] |
147.15
Automatically obtained from RDkit software. |
| LogP |
-0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM43644
Similarity: 0.7129
Similarity to MM43644
| Tanimoto metric | 0.7129 |
|---|---|
| Cosine metric | 0.8443 |
| Dice metric | 0.8324 |
| MW: | 136.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.48 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM315535
Similarity: 0.7105
Similarity to MM315535
| Tanimoto metric | 0.7105 |
|---|---|
| Cosine metric | 0.8313 |
| Dice metric | 0.8308 |
| MW: | 145.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.4 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316001
Similarity: 0.7009
Similarity to MM316001
| Tanimoto metric | 0.7009 |
|---|---|
| Cosine metric | 0.8242 |
| Dice metric | 0.8241 |
| MW: | 142.13 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+222 more
