General Information of the Compound
| Compound ID |
CP0062794
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| Compound Name |
7-(2-aminopyrimidin-5-yl)-1-(dicyclopropylmethylamino)-5H-pyrido[4,3-b]indole-4-carboxamide
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| Structure |
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| Formula |
C23H23N7O
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| Molecular Weight |
413.485
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| Canonical SMILES |
NC(=O)c1cnc(NC(C2CC2)C2CC2)c2c3ccc(cc3[nH]c12)-c1cnc(N)nc1
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| InChI |
InChI=1S/C23H23N7O/c24-21(31)16-10-26-22(30-19(11-1-2-11)12-3-4-12)18-15-6-5-13(7-17(15)29-20(16)18)14-8-27-23(25)28-9-14/h5-12,19,29H,1-4H2,(H2,24,31)(H,26,30)(H2,25,27,28)
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| InChIKey |
HBDARCLZIJMRIA-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