General Information of the Compound
| Compound ID |
CP0865093
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| Compound Name |
6-Bromo-8-methyl-2-(3-(naphthalen-1-yl)-1H-pyrazol-4-yl)-2,3-dihydroquinazolin-4(1H)-one
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| Structure |
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| Formula |
C22H17BrN4O
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| Molecular Weight |
433.309
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| Canonical SMILES |
Cc1cc(Br)cc2c1NC(c1c[nH]nc1-c1cccc3ccccc13)NC2=O
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| InChI |
InChI=1S/C22H17BrN4O/c1-12-9-14(23)10-17-19(12)25-21(26-22(17)28)18-11-24-27-20(18)16-8-4-6-13-5-2-3-7-15(13)16/h2-11,21,25H,1H3,(H,24,27)(H,26,28)
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| InChIKey |
HMTOXAAOXBALFX-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