Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM169990
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM169990 |
| SMILES |
C=C(C=O)C=CCC=O
|
| InChIKey |
JMYGXCOPNYCOKS-UHFFFAOYSA-N
|
| MW [Da] |
124.14
Automatically obtained from RDkit software. |
| LogP |
0.89
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM114323
Similarity: 0.8947
Similarity to MM114323
| Tanimoto metric | 0.8947 |
|---|---|
| Cosine metric | 0.9459 |
| Dice metric | 0.9444 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM145803
Similarity: 0.8462
Similarity to MM145803
| Tanimoto metric | 0.8462 |
|---|---|
| Cosine metric | 0.9178 |
| Dice metric | 0.9167 |
| MW: | 122.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.87 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM106312
Similarity: 0.7895
Similarity to MM106312
| Tanimoto metric | 0.7895 |
|---|---|
| Cosine metric | 0.8885 |
| Dice metric | 0.8824 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+518 more
