General Information of the Compound
| Compound ID |
CP0424488
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| Compound Name |
N-(3-methylsulfanylphenyl)quinazolin-4-amine
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| Structure |
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| Formula |
C15H13N3S
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| Molecular Weight |
267.357
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| Canonical SMILES |
CSc1cccc(Nc2ncnc3ccccc23)c1
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| InChI |
InChI=1S/C15H13N3S/c1-19-12-6-4-5-11(9-12)18-15-13-7-2-3-8-14(13)16-10-17-15/h2-10H,1H3,(H,16,17,18)
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| InChIKey |
ZLTVUJQOKVLDOP-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound