Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM244041
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM244041 |
| SMILES |
CC(=O)C(C)(C=O)CC=O
|
| InChIKey |
CTABZFYCCYYCPU-UHFFFAOYSA-N
|
| MW [Da] |
142.15
Automatically obtained from RDkit software. |
| LogP |
0.37
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM140025
Similarity: 0.7553
Similarity to MM140025
| Tanimoto metric | 0.7553 |
|---|---|
| Cosine metric | 0.8691 |
| Dice metric | 0.8606 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM243896
Similarity: 0.7426
Similarity to MM243896
| Tanimoto metric | 0.7426 |
|---|---|
| Cosine metric | 0.8543 |
| Dice metric | 0.8523 |
| MW: | 142.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 1.58 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM132723
Similarity: 0.734
Similarity to MM132723
| Tanimoto metric | 0.734 |
|---|---|
| Cosine metric | 0.8568 |
| Dice metric | 0.8466 |
| MW: | 128.17 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 1.19 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+114 more
