General Information of the Compound
| Compound ID |
CP0458254
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| Compound Name |
7-fluoro-1-[3-[4-(2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propyl]-3,4-dihydroquinolin-2-one
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| Structure |
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| Formula |
C24H27FN4O2
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| Molecular Weight |
422.504
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| Canonical SMILES |
Fc1ccc2CCC(=O)N(CCCN3CCC(CC3)n3c4ccccc4[nH]c3=O)c2c1
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| InChI |
InChI=1S/C24H27FN4O2/c25-18-8-6-17-7-9-23(30)28(22(17)16-18)13-3-12-27-14-10-19(11-15-27)29-21-5-2-1-4-20(21)26-24(29)31/h1-2,4-6,8,16,19H,3,7,9-15H2,(H,26,31)
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| InChIKey |
ABUDXXYFKLCSKO-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: PT01005, D(2) dopamine receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2