General Information of the Compound
| Compound ID |
CP0420610
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| Compound Name |
4-tert-butyl-N-[2-methyl-3-[5-[4-(morpholine-4-carbonyl)anilino]-6-oxo-1H-pyrazin-3-yl]phenyl]benzamide
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| Structure |
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| Formula |
C33H35N5O4
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| Molecular Weight |
565.674
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| Canonical SMILES |
Cc1c(NC(=O)c2ccc(cc2)C(C)(C)C)cccc1-c1c[nH]c(=O)c(Nc2ccc(cc2)C(=O)N2CCOCC2)n1
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| InChI |
InChI=1S/C33H35N5O4/c1-21-26(6-5-7-27(21)37-30(39)22-8-12-24(13-9-22)33(2,3)4)28-20-34-31(40)29(36-28)35-25-14-10-23(11-15-25)32(41)38-16-18-42-19-17-38/h5-15,20H,16-19H2,1-4H3,(H,34,40)(H,35,36)(H,37,39)
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| InChIKey |
VOXYABSFWCBZKH-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