General Information of the Compound
| Compound ID |
CP0468991
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| Compound Name |
N-[1-(Fluoromethyl)cyclopropyl]-1-methyl-3-[(1-methylpyrazol-4-yl)methyl]-2,4-dioxo-quinazoline-6-sulfonamide
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| Structure |
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| Formula |
C18H20FN5O4S
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| Molecular Weight |
421.454
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| Canonical SMILES |
Cn1cc(Cn2c(=O)n(C)c3ccc(cc3c2=O)S(=O)(=O)NC2(CF)CC2)cn1
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| InChI |
InChI=1S/C18H20FN5O4S/c1-22-9-12(8-20-22)10-24-16(25)14-7-13(3-4-15(14)23(2)17(24)26)29(27,28)21-18(11-19)5-6-18/h3-4,7-9,21H,5-6,10-11H2,1-2H3
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| InChIKey |
DCNRZHQYMXKMBD-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