SMILES |
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Property | Value | Detail |
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Absorption logBB |
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Absorption logPS |
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Absorption Caco-2 permeability |
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Absorption P-gp inhibition |
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Absorption P-gp substrate |
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Metabolism CYP1A2 inhibition |
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CYP1A2 inhibition (Rule 1) | ||
CYP1A2 inhibition (Rule 2) | ||
CYP1A2 inhibition (Rule 3) | ||
CYP1A2 inhibition (Rule 4) | ||
CYP1A2 inhibition (Rule 5) | ||
Metabolism CYP2C9 inhibition |
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CYP2C9 inhibition (Rule 1) | ||
CYP2C9 inhibition (Rule 2) | ||
CYP2C9 inhibition (Rule 3) | ||
CYP2C9 inhibition (Rule 4) | ||
CYP2C9 inhibition (Rule 5) | ||
Metabolism CYP2C19 inhibition |
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CYP2C19 inhibition (Rule 1) | ||
CYP2C19 inhibition (Rule 2) | ||
CYP2C19 inhibition (Rule 3) | ||
CYP2C19 inhibition (Rule 4) | ||
CYP2C19 inhibition (Rule 5) | ||
Metabolism CYP2D6 inhibition |
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CYP2D6 inhibition (Rule 1) | ||
CYP2D6 inhibition (Rule 2) | ||
CYP2D6 inhibition (Rule 3) | ||
CYP2D6 inhibition (Rule 4) | ||
CYP2D6 inhibition (Rule 5) | ||
Metabolism CYP3A4 inhibition |
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CYP3A4 inhibition (Rule 1) | ||
CYP3A4 inhibition (Rule 2) | ||
CYP3A4 inhibition (Rule 3) | ||
CYP3A4 inhibition (Rule 4) | ||
CYP3A4 inhibition (Rule 5) | ||
Toxicity hERG inhibition |
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Toxicity Cytotoxicity |
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Toxicity Mutagenicity |