General Information of the Compound
| Compound ID |
CP0458386
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| Compound Name |
2-[8-(hydroxyamino)-8-oxooctoxy]-N-(7H-purin-6-yl)benzamide
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| Structure |
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| Formula |
C20H24N6O4
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| Molecular Weight |
412.45
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| Canonical SMILES |
ONC(=O)CCCCCCCOc1ccccc1C(=O)Nc1ncnc2[nH]cnc12
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| InChI |
InChI=1S/C20H24N6O4/c27-16(26-29)10-4-2-1-3-7-11-30-15-9-6-5-8-14(15)20(28)25-19-17-18(22-12-21-17)23-13-24-19/h5-6,8-9,12-13,29H,1-4,7,10-11H2,(H,26,27)(H2,21,22,23,24,25,28)
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| InChIKey |
AZBPOTYBYHEXEU-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