General Information of the Compound
| Compound ID |
CP0497329
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| Compound Name |
3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]quinazolin-4-one
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| Structure |
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| Formula |
C21H23ClN4O
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| Molecular Weight |
382.895
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| Canonical SMILES |
Clc1cccc(c1)N1CCN(CCCn2cnc3ccccc3c2=O)CC1
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| InChI |
InChI=1S/C21H23ClN4O/c22-17-5-3-6-18(15-17)25-13-11-24(12-14-25)9-4-10-26-16-23-20-8-2-1-7-19(20)21(26)27/h1-3,5-8,15-16H,4,9-14H2
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| InChIKey |
QRTNQVOGBIPAAV-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