General Information of the Compound
| Compound ID |
CP0190262
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| Compound Name |
[5-amino-2-[2-(4-methoxy-2-methylphenyl)ethyl]benzo[f][1,7]naphthyridine-8-carbonyl]phosphonic acid
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| Structure |
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| Formula |
C23H22N3O5P
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| Molecular Weight |
451.419
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| Canonical SMILES |
COc1ccc(CCc2cnc3c(N)nc4cc(ccc4c3c2)C(=O)P(O)(O)=O)c(C)c1
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| InChI |
InChI=1S/C23H22N3O5P/c1-13-9-17(31-2)7-5-15(13)4-3-14-10-19-18-8-6-16(23(27)32(28,29)30)11-20(18)26-22(24)21(19)25-12-14/h5-12H,3-4H2,1-2H3,(H2,24,26)(H2,28,29,30)
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| InChIKey |
PZYDOTXOIYNCTL-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