Identifier: MM274851
2D Structure
3D Structure
Source:
General | |
Identifier | MM274851 |
SMILES |
CC(C)(C)C(O)C(=O)O
|
InChIKey |
FWVNWTNCNWRCOU-UHFFFAOYSA-N
|
MW [Da] |
132.16
Automatically obtained from RDkit software. |
LogP |
0.48
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 | 0.7978 |
---|---|
Cosine metric | 0.8932 |
Dice metric | 0.8875 |
MW: | 118.13 |
||||
---|---|---|---|---|---|
PI: | 2
Total passive interactions
|
LogP: | 0.09 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
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MM223809
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Similarity to MM223809
Tanimoto metric | 0.7236 |
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Cosine metric | 0.8506 |
Dice metric | 0.8396 |
MW: | 146.19 |
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PI: | 3
Total passive interactions
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LogP: | 0.57 |
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AI: | 0
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Similarity: 0.7008
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Tanimoto metric | 0.7008 |
---|---|
Cosine metric | 0.8371 |
Dice metric | 0.8241 |
MW: | 148.16 |
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PI: | 3
Total passive interactions
|
LogP: | -0.55 |
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---|---|---|---|---|---|
AI: | 0
Total active interactions
|
+244 more