General Information of the Compound
| Compound ID |
CP0400970
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| Compound Name |
3-(4-[(1-Butyl-4-piperidinyl)oxy]phenyl)-2-methyl-4(3H)-quinazolinone
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| Structure |
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| Formula |
C24H29N3O2
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| Molecular Weight |
391.515
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| Canonical SMILES |
CCCCN1CCC(CC1)Oc1ccc(cc1)-n1c(C)nc2ccccc2c1=O
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| InChI |
InChI=1S/C24H29N3O2/c1-3-4-15-26-16-13-21(14-17-26)29-20-11-9-19(10-12-20)27-18(2)25-23-8-6-5-7-22(23)24(27)28/h5-12,21H,3-4,13-17H2,1-2H3
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| InChIKey |
FBQZQGMQBBKOGP-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