Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM173837
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM173837 |
| SMILES |
C=C(C=O)C(=C)CC=O
|
| InChIKey |
ZBISBXQDARJWKG-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
MM112123
Similarity: 0.8378
Similarity to MM112123
| Tanimoto metric | 0.8378 |
|---|---|
| Cosine metric | 0.9153 |
| Dice metric | 0.9118 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM34648
Similarity: 0.7838
Similarity to MM34648
| Tanimoto metric | 0.7838 |
|---|---|
| Cosine metric | 0.8853 |
| Dice metric | 0.8788 |
| MW: | 110.16 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 1.71 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM173670
Similarity: 0.6905
Similarity to MM173670
| Tanimoto metric | 0.6905 |
|---|---|
| Cosine metric | 0.8176 |
| Dice metric | 0.8169 |
| MW: | 124.18 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 2.1 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+405 more
