Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM361318
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM361318 |
| SMILES |
CCC(=O)C(C)=CC=CF
|
| InChIKey |
QAYRJIOYYKWQNJ-UHFFFAOYSA-N
|
| MW [Da] |
142.17
Automatically obtained from RDkit software. |
| LogP |
2.4
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM175519
Similarity: 0.8103
Similarity to MM175519
| Tanimoto metric | 0.8103 |
|---|---|
| Cosine metric | 0.9002 |
| Dice metric | 0.8952 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM163996
Similarity: 0.7672
Similarity to MM163996
| Tanimoto metric | 0.7672 |
|---|---|
| Cosine metric | 0.8759 |
| Dice metric | 0.8683 |
| MW: | 128.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM361316
Similarity: 0.7252
Similarity to MM361316
| Tanimoto metric | 0.7252 |
|---|---|
| Cosine metric | 0.841 |
| Dice metric | 0.8407 |
| MW: | 138.21 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.49 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+431 more
