General Information of the Compound
| Compound ID |
CP0930358
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| Compound Name |
2-(3-Carbamoyl-4-(piperidin-1-yl)phenyl)-3-hydroxy-4-oxo-N-pentyl-1,4-dihydroquinoline-7-carboxamide
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| Structure |
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| Formula |
C27H32N4O4
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| Molecular Weight |
476.577
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| Canonical SMILES |
CCCCCNC(=O)c1ccc2c(=O)c(O)c(-c3ccc(N4CCCCC4)c(C(N)=O)c3)[nH]c2c1
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| InChI |
InChI=1S/C27H32N4O4/c1-2-3-5-12-29-27(35)18-8-10-19-21(16-18)30-23(25(33)24(19)32)17-9-11-22(20(15-17)26(28)34)31-13-6-4-7-14-31/h8-11,15-16,33H,2-7,12-14H2,1H3,(H2,28,34)(H,29,35)(H,30,32)
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| InChIKey |
BGBIJENWTOVPPV-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