Identifier: MM246795
2D Structure
3D Structure
Source:
General | |
Identifier | MM246795 |
SMILES |
C=C(C)C(=O)CC(=O)CC
|
InChIKey |
JTAXJHNPYJDHFS-UHFFFAOYSA-N
|
MW [Da] |
140.18
Automatically obtained from RDkit software. |
LogP |
1.5
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
N/A |
Similar entries
5-methylhex-5-ene-2,4-dione
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Similarity to 5-methylhex-5-ene-2,4-dione
Tanimoto metric | 0.9063 |
---|---|
Cosine metric | 0.952 |
Dice metric | 0.9508 |
MW: | 126.16 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 1.11 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
MM15789
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Tanimoto metric | 0.7459 |
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Cosine metric | 0.8586 |
Dice metric | 0.8545 |
MW: | 138.17 |
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---|---|---|---|---|---|
PI: | 1
Total passive interactions
|
LogP: | 1.28 |
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AI: | 0
Total active interactions
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MM263575
Similarity: 0.7451
Similarity to MM263575
Tanimoto metric | 0.7451 |
---|---|
Cosine metric | 0.8566 |
Dice metric | 0.8539 |
MW: | 140.18 |
||||
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PI: | 3
Total passive interactions
|
LogP: | 1.5 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+67 more