General Information of the Compound
| Compound ID |
CP0522565
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| Compound Name |
2-Methyl-3-(4-[(1-methyl-4-piperidinyl)oxy]phenyl)-4(3H)-quinazolinone
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| Structure |
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| Formula |
C21H23N3O2
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| Molecular Weight |
349.434
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| Canonical SMILES |
CN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
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| InChI |
InChI=1S/C21H23N3O2/c1-15-22-20-6-4-3-5-19(20)21(25)24(15)16-7-9-17(10-8-16)26-18-11-13-23(2)14-12-18/h3-10,18H,11-14H2,1-2H3
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| InChIKey |
YBPLMSZYRHWSQS-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