General Information of the Compound
| Compound ID |
CP0487816
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| Compound Name |
N-ethyl-2-[3-(3-methoxyphenyl)-1-oxo-7-(3-piperidin-1-ylpropoxy)pyrrolo[1,2-a]pyrazin-2-yl]acetamide
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| Structure |
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| Formula |
C26H34N4O4
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| Molecular Weight |
466.582
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| Canonical SMILES |
CCNC(=O)Cn1c(cn2cc(OCCCN3CCCCC3)cc2c1=O)-c1cccc(OC)c1
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| InChI |
InChI=1S/C26H34N4O4/c1-3-27-25(31)19-30-24(20-9-7-10-21(15-20)33-2)18-29-17-22(16-23(29)26(30)32)34-14-8-13-28-11-5-4-6-12-28/h7,9-10,15-18H,3-6,8,11-14,19H2,1-2H3,(H,27,31)
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| InChIKey |
GNSXCGRCXOXNQV-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