Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM84734
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM84734 |
| SMILES |
C=CC(=O)C(C)OCCO
|
| InChIKey |
QTCSZXVZARDFMY-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.14
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM172727
Similarity: 0.8376
Similarity to MM172727
| Tanimoto metric | 0.8376 |
|---|---|
| Cosine metric | 0.9152 |
| Dice metric | 0.9116 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.17 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349678
Similarity: 0.7615
Similarity to MM349678
| Tanimoto metric | 0.7615 |
|---|---|
| Cosine metric | 0.8648 |
| Dice metric | 0.8646 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.56 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM349826
Similarity: 0.7246
Similarity to MM349826
| Tanimoto metric | 0.7246 |
|---|---|
| Cosine metric | 0.8405 |
| Dice metric | 0.8403 |
| MW: | 139.15 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.67 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+242 more
