Identifier: MM317352
2D Structure
3D Structure
Source:
General | |
Identifier | MM317352 |
SMILES |
CCC(=O)OCC(=O)O
|
InChIKey |
HJYGWLFMHCJRJG-UHFFFAOYSA-N
|
MW [Da] |
132.12
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 |
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Similarity to 2-(2-methylpropanoyloxy)acetic Acid
Tanimoto metric | 0.8163 |
---|---|
Cosine metric | 0.9035 |
Dice metric | 0.8989 |
MW: | 146.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.27 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM433490
Similarity: 0.8
Similarity to MM433490
Tanimoto metric | 0.8 |
---|---|
Cosine metric | 0.8944 |
Dice metric | 0.8889 |
MW: | 143.1 |
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---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | -0.47 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM62954
Similarity: 0.7767
Similarity to MM62954
Tanimoto metric | 0.7767 |
---|---|
Cosine metric | 0.8813 |
Dice metric | 0.8743 |
MW: | 142.11 |
||||
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PI: | 1
Total passive interactions
|
LogP: | -0.36 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+304 more