Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM297852
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM297852 |
| SMILES |
CC(=O)C(C)C(C=O)CO
|
| InChIKey |
KWXNNADSJROQES-UHFFFAOYSA-N
|
| MW [Da] |
144.17
Automatically obtained from RDkit software. |
| LogP |
0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM388514
Similarity: 0.8522
Similarity to MM388514
| Tanimoto metric | 0.8522 |
|---|---|
| Cosine metric | 0.9203 |
| Dice metric | 0.9202 |
| MW: | 144.17 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.02 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM44485
Similarity: 0.7407
Similarity to MM44485
| Tanimoto metric | 0.7407 |
|---|---|
| Cosine metric | 0.8607 |
| Dice metric | 0.8511 |
| MW: | 130.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.23 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM196928
Similarity: 0.6667
Similarity to MM196928
| Tanimoto metric | 0.6667 |
|---|---|
| Cosine metric | 0.8165 |
| Dice metric | 0.8 |
| MW: | 130.19 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.84 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+243 more
