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Documentation2-formyloxy-2-methylpropanoic Acid
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM03481 |
| SMILES |
CC(C)(OC=O)C(=O)O
|
| InChIKey |
BXXOFUQIACXFIW-UHFFFAOYSA-N
|
| MW [Da] |
132.12
Automatically obtained from RDkit software. |
| LogP |
0.02
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
53918371
|
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM233416
Similarity: 0.7594
Similarity to MM233416
| Tanimoto metric | 0.7594 |
|---|---|
| Cosine metric | 0.8714 |
| Dice metric | 0.8632 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 3
Total passive interactions
|
| LogP: | 0.11 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM391868
Similarity: 0.7319
Similarity to MM391868
| Tanimoto metric | 0.7319 |
|---|---|
| Cosine metric | 0.8555 |
| Dice metric | 0.8452 |
| MW: | 148.11 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -1.01 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM314693
Similarity: 0.6516
Similarity to MM314693
| Tanimoto metric | 0.6516 |
|---|---|
| Cosine metric | 0.8072 |
| Dice metric | 0.7891 |
| MW: | 146.14 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.41 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+23 more
