Identifier: MM352411
2D Structure
3D Structure
Source:
General | |
Identifier | MM352411 |
SMILES |
C=C(C=O)C(=O)C(C)C=O
|
InChIKey |
VAGDEFFIUNAEKM-UHFFFAOYSA-N
|
MW [Da] |
140.14
Automatically obtained from RDkit software. |
LogP |
0.15
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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Tanimoto metric | 0.8167 |
---|---|
Cosine metric | 0.9037 |
Dice metric | 0.8991 |
MW: | 126.16 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.97 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM161232
Similarity: 0.7583
Similarity to MM161232
Tanimoto metric | 0.7583 |
---|---|
Cosine metric | 0.8708 |
Dice metric | 0.8626 |
MW: | 126.16 |
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---|---|---|---|---|---|
PI: | 3
Total passive interactions
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LogP: | 0.97 |
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AI: | 0
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MM352161
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Similarity to MM352161
Tanimoto metric | 0.7063 |
---|---|
Cosine metric | 0.828 |
Dice metric | 0.8279 |
MW: | 140.18 |
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---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.36 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+79 more