Chembl452325
2D Structure
3D Structure
Source:
General | |
Identifier | MM469359 |
SMILES |
CNC(CC(C)C)C(=O)NCCCC(c1ccc(F)cc1)c1ccc(F)cc1
|
InChIKey |
QGJKMAIASNMXFI-UHFFFAOYSA-N
|
MW [Da] |
388.5
Automatically obtained from RDkit software. |
LogP |
4.63
Automatically obtained from RDkit software. |
Links | |
PubChem |
N/A |
DrugBank |
N/A |
ChEBI |
N/A |
PDB |
N/A |
ChEMBL |
Chembl452325
|
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Tanimoto metric | 0.7936 |
---|---|
Cosine metric | 0.8906 |
Dice metric | 0.8849 |
MW: | 485.62 |
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PI: | 0
Total passive interactions
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LogP: | 4.62 |
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AI: | 0
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MM20647
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Tanimoto metric | 0.6654 |
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Cosine metric | 0.7993 |
Dice metric | 0.7991 |
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PI: | 1
Total passive interactions
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LogP: | 3.83 |
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AI: | 0
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MM20993
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Similarity to MM20993
Tanimoto metric | 0.6463 |
---|---|
Cosine metric | 0.7857 |
Dice metric | 0.7851 |
MW: | 476.61 |
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PI: | 1
Total passive interactions
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LogP: | 6.04 |
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AI: | 0
Total active interactions
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+15 more