General Information of the Compound
| Compound ID |
CP0074985
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| Compound Name |
3-(3-fluoro-4-hydroxyphenyl)-5,7-dihydroxy-3,4-dihydroquinazoline-4-thione
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| Structure |
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| Formula |
C14H9FN2O3S
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| Molecular Weight |
304.302
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| Canonical SMILES |
Oc1cc(O)c2c(c1)ncn(-c1ccc(O)c(F)c1)c2=S
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| InChI |
InChI=1S/C14H9FN2O3S/c15-9-3-7(1-2-11(9)19)17-6-16-10-4-8(18)5-12(20)13(10)14(17)21/h1-6,18-20H
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| InChIKey |
PXSTXQBNCZBQMC-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