Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM406144
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM406144 |
| SMILES |
CCC=CCC(C=O)CF
|
| InChIKey |
HEYKMACMKIICAK-UHFFFAOYSA-N
|
| MW [Da] |
144.19
Automatically obtained from RDkit software. |
| LogP |
2.13
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM199500
Similarity: 0.9048
Similarity to MM199500
| Tanimoto metric | 0.9048 |
|---|---|
| Cosine metric | 0.9512 |
| Dice metric | 0.95 |
| MW: | 130.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.74 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406148
Similarity: 0.7917
Similarity to MM406148
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.884 |
| Dice metric | 0.8837 |
| MW: | 148.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.69 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM406431
Similarity: 0.7755
Similarity to MM406431
| Tanimoto metric | 0.7755 |
|---|---|
| Cosine metric | 0.8741 |
| Dice metric | 0.8736 |
| MW: | 142.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.9 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+668 more
