General Information of the Compound
| Compound ID |
CP0638212
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| Compound Name |
N-(5-Methyl-pyrazin-2-ylmethyl)-3-(5-methyl-pyridin-2-yl)-5-(5-oxo-6-oxa-4-aza-spiro[2.4]hept-4-yl)-benzamide
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| Structure |
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| Formula |
C24H23N5O3
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| Molecular Weight |
429.48
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| Canonical SMILES |
Cc1ccc(-c2cc(C(=O)NCc3cnc(C)cn3)cc(N3C(=O)OCC34CC4)c2)nc1
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| InChI |
InChI=1S/C24H23N5O3/c1-15-3-4-21(27-10-15)17-7-18(22(30)28-13-19-12-25-16(2)11-26-19)9-20(8-17)29-23(31)32-14-24(29)5-6-24/h3-4,7-12H,5-6,13-14H2,1-2H3,(H,28,30)
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| InChIKey |
MJOIQVQXAGARNV-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