General Information of the Compound
| Compound ID |
CP0451848
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| Compound Name |
3-[5-[4-(2-ethoxyphenyl)piperazin-1-yl]pentyl]quinazolin-4-one
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| Structure |
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| Formula |
C25H32N4O2
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| Molecular Weight |
420.557
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| Canonical SMILES |
CCOc1ccccc1N1CCN(CCCCCn2cnc3ccccc3c2=O)CC1
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| InChI |
InChI=1S/C25H32N4O2/c1-2-31-24-13-7-6-12-23(24)28-18-16-27(17-19-28)14-8-3-9-15-29-20-26-22-11-5-4-10-21(22)25(29)30/h4-7,10-13,20H,2-3,8-9,14-19H2,1H3
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| InChIKey |
IXBNJEOOOLYFIU-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
Protein ID: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00941, 5-hydroxytryptamine receptor 7