General Information of the Compound
| Compound ID |
CP0546231
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| Compound Name |
N-methyl-2-[4-[4-(6-oxo-1-propan-2-ylpyridin-3-yl)-1H-pyrrolo[2,3-b]pyridin-2-yl]piperidin-1-yl]acetamide
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| Structure |
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| Formula |
C23H29N5O2
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| Molecular Weight |
407.518
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| Canonical SMILES |
CNC(=O)CN1CCC(CC1)c1cc2c(ccnc2[nH]1)-c1ccc(=O)n(c1)C(C)C
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| InChI |
InChI=1S/C23H29N5O2/c1-15(2)28-13-17(4-5-22(28)30)18-6-9-25-23-19(18)12-20(26-23)16-7-10-27(11-8-16)14-21(29)24-3/h4-6,9,12-13,15-16H,7-8,10-11,14H2,1-3H3,(H,24,29)(H,25,26)
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| InChIKey |
GZXWMFLENSULBI-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