Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM141626
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM141626 |
| SMILES |
CCC(C)CC(F)C=O
|
| InChIKey |
OKWLIOUFWJXZCC-UHFFFAOYSA-N
|
| MW [Da] |
132.18
Automatically obtained from RDkit software. |
| LogP |
1.96
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM326149
Similarity: 0.9367
Similarity to MM326149
| Tanimoto metric | 0.9367 |
|---|---|
| Cosine metric | 0.9678 |
| Dice metric | 0.9673 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.35 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM244745
Similarity: 0.8315
Similarity to MM244745
| Tanimoto metric | 0.8315 |
|---|---|
| Cosine metric | 0.9118 |
| Dice metric | 0.908 |
| MW: | 146.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.21 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM104203
Similarity: 0.7297
Similarity to MM104203
| Tanimoto metric | 0.7297 |
|---|---|
| Cosine metric | 0.8542 |
| Dice metric | 0.8438 |
| MW: | 118.15 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.57 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+366 more
