Identifier: MM142530
2D Structure
3D Structure
Source:
General | |
Identifier | MM142530 |
SMILES |
CCC(=O)CC(=O)CC
|
InChIKey |
DGCTVLNZTFDPDJ-UHFFFAOYSA-N
|
MW [Da] |
128.17
Automatically obtained from RDkit software. |
LogP |
1.33
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
Hexane-2,4-dione
Similarity: 0.9111
Similarity to Hexane-2,4-dione
Tanimoto metric | 0.9111 |
---|---|
Cosine metric | 0.9545 |
Dice metric | 0.9535 |
MW: | 114.14 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.94 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM246251
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Similarity to MM246251
Tanimoto metric | 0.6522 |
---|---|
Cosine metric | 0.8076 |
Dice metric | 0.7895 |
MW: | 142.2 |
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---|---|---|---|---|---|
PI: | 3
Total passive interactions
|
LogP: | 1.58 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM263296
Similarity: 0.6338
Similarity to MM263296
Tanimoto metric | 0.6338 |
---|---|
Cosine metric | 0.7961 |
Dice metric | 0.7759 |
MW: | 140.18 |
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PI: | 3
Total passive interactions
|
LogP: | 1.5 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+49 more