General Information of the Compound
| Compound ID |
CP0639090
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| Compound Name |
(+/-)-N-{5-[2-(1-Cyclopropylethyl)-7-methyl-1-oxo-2,3-dihydro-1H-isoindol-5-yl]-1H-1,3-benzodiazol-2-yl}-acetamide
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| Formula |
C23H24N4O2
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| Molecular Weight |
388.471
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| Canonical SMILES |
CC(=O)Nc1nc2cc(-c3cc(C)c4c(c3)CN([C@@H](C)C3CC3)C4=O)ccc2[nH]1
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| InChI |
InChI=1S/C23H24N4O2/c1-12-8-17(9-18-11-27(22(29)21(12)18)13(2)15-4-5-15)16-6-7-19-20(10-16)26-23(25-19)24-14(3)28/h6-10,13,15H,4-5,11H2,1-3H3,(H2,24,25,26,28)/t13-/m0/s1
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| InChIKey |
FGRYSELYJLRQCW-ZDUSSCGKSA-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