General Information of the Compound
| Compound ID |
CP0498458
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| Compound Name |
8-Bromo-4,4-dipropyl-3,4-dihydro-1H-quinazolin-2-one
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| Structure |
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| Formula |
C14H19BrN2O
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| Molecular Weight |
311.223
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| Canonical SMILES |
CCCC1(CCC)NC(=O)Nc2c(Br)cccc12
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| InChI |
InChI=1S/C14H19BrN2O/c1-3-8-14(9-4-2)10-6-5-7-11(15)12(10)16-13(18)17-14/h5-7H,3-4,8-9H2,1-2H3,(H2,16,17,18)
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| InChIKey |
GGOVELLLSQUTBK-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