Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM250726
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM250726 |
| SMILES |
CC(=O)CCC(O)CC=O
|
| InChIKey |
UEAFSOXYYNVTGA-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.31
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM250613
Similarity: 0.8718
Similarity to MM250613
| Tanimoto metric | 0.8718 |
|---|---|
| Cosine metric | 0.9323 |
| Dice metric | 0.9315 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM316320
Similarity: 0.7333
Similarity to MM316320
| Tanimoto metric | 0.7333 |
|---|---|
| Cosine metric | 0.8464 |
| Dice metric | 0.8462 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.52 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM254560
Similarity: 0.7128
Similarity to MM254560
| Tanimoto metric | 0.7128 |
|---|---|
| Cosine metric | 0.8336 |
| Dice metric | 0.8323 |
| MW: | 144.21 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+396 more
