General Information of the Compound
| Compound ID |
CP0006929
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| Compound Name |
N-[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]-1,6-naphthyridine-8-carboxamide
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| Structure |
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| Formula |
C26H19ClN4O2
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| Molecular Weight |
454.917
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| Canonical SMILES |
C[C@H](NC(=O)c1cncc2cccnc12)c1cc2cccc(Cl)c2c(=O)n1-c1ccccc1
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| InChI |
InChI=1S/C26H19ClN4O2/c1-16(30-25(32)20-15-28-14-18-8-6-12-29-24(18)20)22-13-17-7-5-11-21(27)23(17)26(33)31(22)19-9-3-2-4-10-19/h2-16H,1H3,(H,30,32)/t16-/m0/s1
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| InChIKey |
AGZPGVIJBUSPBO-INIZCTEOSA-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