General Information of the Compound
| Compound ID |
CP0399300
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| Compound Name |
2-[3-(3-chlorophenyl)-7-[(1-methylpiperidin-3-yl)methoxy]-1-oxopyrrolo[1,2-a]pyrazin-2-yl]-N-propan-2-ylacetamide
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| Structure |
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| Formula |
C25H31ClN4O3
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| Molecular Weight |
471.001
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| Canonical SMILES |
CC(C)NC(=O)Cn1c(cn2cc(OCC3CCCN(C)C3)cc2c1=O)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C25H31ClN4O3/c1-17(2)27-24(31)15-30-23(19-7-4-8-20(26)10-19)14-29-13-21(11-22(29)25(30)32)33-16-18-6-5-9-28(3)12-18/h4,7-8,10-11,13-14,17-18H,5-6,9,12,15-16H2,1-3H3,(H,27,31)
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| InChIKey |
MVFHCGZNTFNKJF-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