Identifier: MM169596
2D Structure
3D Structure
Source:
General | |
Identifier | MM169596 |
SMILES |
C=CC(O)C=CCCC
|
InChIKey |
JKMHYJRORPXHGQ-UHFFFAOYSA-N
|
MW [Da] |
126.2
Automatically obtained from RDkit software. |
LogP |
1.89
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 MM363667
Tanimoto metric | 0.9344 |
---|---|
Cosine metric | 0.9667 |
Dice metric | 0.9661 |
MW: | 138.21 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 2.06 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM324722
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Tanimoto metric | 0.9048 |
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Cosine metric | 0.9512 |
Dice metric | 0.95 |
MW: | 140.23 |
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PI: | 3
Total passive interactions
|
LogP: | 2.28 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
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Similarity to MM363420
Tanimoto metric | 0.8769 |
---|---|
Cosine metric | 0.9364 |
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MW: | 140.23 |
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PI: | 2
Total passive interactions
|
LogP: | 2.28 |
||||
---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+669 more