General Information of the Compound
| Compound ID |
CP0423778
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| Compound Name |
N-(1-adamantyl)-4-butyl-7-hydroxy-2-(2-hydroxyethyl)-5-oxopyrazolo[4,3-b]pyridine-6-carboxamide
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| Structure |
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| Formula |
C23H32N4O4
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| Molecular Weight |
428.533
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| Canonical SMILES |
CCCCn1c2cn(CCO)nc2c(O)c(C(=O)NC23CC4CC(CC(C4)C2)C3)c1=O
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| InChI |
InChI=1S/C23H32N4O4/c1-2-3-4-27-17-13-26(5-6-28)25-19(17)20(29)18(22(27)31)21(30)24-23-10-14-7-15(11-23)9-16(8-14)12-23/h13-16,28-29H,2-12H2,1H3,(H,24,30)
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| InChIKey |
PHTQOYPUVDVNES-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