General Information of the Compound
| Compound ID |
CP0418162
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| Compound Name |
12-oxo-N-(2-piperidin-1-ylethyl)-12H-benzo[g]pyrido[2,1-b]quinazoline-4-carboxamide
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| Structure |
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| Formula |
C24H24N4O2
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| Molecular Weight |
400.482
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| Canonical SMILES |
O=C(NCCN1CCCCC1)c1cccn2c1nc1cc3ccccc3cc1c2=O
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| InChI |
InChI=1S/C24H24N4O2/c29-23(25-10-14-27-11-4-1-5-12-27)19-9-6-13-28-22(19)26-21-16-18-8-3-2-7-17(18)15-20(21)24(28)30/h2-3,6-9,13,15-16H,1,4-5,10-12,14H2,(H,25,29)
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| InChIKey |
TXTDKLMFBBYADC-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