Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM254553
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM254553 |
| SMILES |
CC(CCC(=O)O)C(F)F
|
| InChIKey |
CCDMCWVOERPNBL-UHFFFAOYSA-N
|
| MW [Da] |
152.14
Automatically obtained from RDkit software. |
| LogP |
1.75
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM43685
Similarity: 0.7917
Similarity to MM43685
| Tanimoto metric | 0.7917 |
|---|---|
| Cosine metric | 0.8898 |
| Dice metric | 0.8837 |
| MW: | 134.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.46 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM133015
Similarity: 0.7083
Similarity to MM133015
| Tanimoto metric | 0.7083 |
|---|---|
| Cosine metric | 0.8416 |
| Dice metric | 0.8293 |
| MW: | 138.11 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.51 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM227932
Similarity: 0.6786
Similarity to MM227932
| Tanimoto metric | 0.6786 |
|---|---|
| Cosine metric | 0.8087 |
| Dice metric | 0.8085 |
| MW: | 148.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.85 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+224 more
