General Information of the Compound
| Compound ID |
CP0479273
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| Compound Name |
10-methyl-2-(2-methylpropyl)-3-phenylpyrimido[4,5-b]quinoline-4,5-dione
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| Structure |
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| Formula |
C22H21N3O2
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| Molecular Weight |
359.429
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| Canonical SMILES |
CC(C)Cc1nc2n(C)c3ccccc3c(=O)c2c(=O)n1-c1ccccc1
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| InChI |
InChI=1S/C22H21N3O2/c1-14(2)13-18-23-21-19(22(27)25(18)15-9-5-4-6-10-15)20(26)16-11-7-8-12-17(16)24(21)3/h4-12,14H,13H2,1-3H3
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| InChIKey |
BOHIDHFZQOGFHD-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: PT01195, D(1A) dopamine receptor
Protein ID: PT01169, D(1B) dopamine receptor