General Information of the Compound
| Compound ID |
CP0477292
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| Compound Name |
3-[5-(4-benzylpiperazin-1-yl)pentyl]quinazolin-4-one
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| Structure |
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| Formula |
C24H30N4O
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| Molecular Weight |
390.531
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| Canonical SMILES |
O=c1n(CCCCCN2CCN(Cc3ccccc3)CC2)cnc2ccccc12
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| InChI |
InChI=1S/C24H30N4O/c29-24-22-11-5-6-12-23(22)25-20-28(24)14-8-2-7-13-26-15-17-27(18-16-26)19-21-9-3-1-4-10-21/h1,3-6,9-12,20H,2,7-8,13-19H2
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| InChIKey |
DYBXDQPAKLWKBW-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