General Information of the Compound
| Compound ID |
CP0482429
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| Compound Name |
N-[1-(1H-imidazol-2-yl)-2-(7-methyl-1H-indazol-5-yl)ethyl]-4-(2-oxo-1,4-dihydroquinazolin-3-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C27H30N8O2
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| Molecular Weight |
498.591
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| Canonical SMILES |
Cc1cc(CC(NC(=O)N2CCC(CC2)N2Cc3ccccc3NC2=O)c2ncc[nH]2)cc2cn[nH]c12
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| InChI |
InChI=1S/C27H30N8O2/c1-17-12-18(13-20-15-30-33-24(17)20)14-23(25-28-8-9-29-25)32-26(36)34-10-6-21(7-11-34)35-16-19-4-2-3-5-22(19)31-27(35)37/h2-5,8-9,12-13,15,21,23H,6-7,10-11,14,16H2,1H3,(H,28,29)(H,30,33)(H,31,37)(H,32,36)
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| InChIKey |
IDPBTEJQUPTFEX-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