General Information of the Compound
| Compound ID |
CP0010602
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| Compound Name |
N-[6-[2-[(1S)-1-cyclopropylethyl]-7-methyl-1-oxo-3H-isoindol-5-yl]imidazo[1,2-b]pyridazin-2-yl]propanamide
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| Formula |
C23H25N5O2
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| Molecular Weight |
403.486
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| Canonical SMILES |
CCC(=O)Nc1cn2nc(ccc2n1)-c1cc2CN([C@@H](C)C3CC3)C(=O)c2c(C)c1
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| InChI |
InChI=1S/C23H25N5O2/c1-4-21(29)25-19-12-28-20(24-19)8-7-18(26-28)16-9-13(2)22-17(10-16)11-27(23(22)30)14(3)15-5-6-15/h7-10,12,14-15H,4-6,11H2,1-3H3,(H,25,29)/t14-/m0/s1
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| InChIKey |
JBQPEQUJYSALIP-AWEZNQCLSA-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
Protein ID: PT01029, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform