General Information of the Compound
| Compound ID |
CP0580164
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| Compound Name |
3-amino-6-[4-[(dimethylamino)methyl]phenyl]-N-(4-hydroxycyclohexyl)pyrazine-2-carboxamide
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| Structure |
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| Formula |
C20H27N5O2
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| Molecular Weight |
369.469
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| Canonical SMILES |
CN(C)Cc1ccc(cc1)-c1cnc(N)c(n1)C(=O)NC1CCC(O)CC1
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| InChI |
InChI=1S/C20H27N5O2/c1-25(2)12-13-3-5-14(6-4-13)17-11-22-19(21)18(24-17)20(27)23-15-7-9-16(26)10-8-15/h3-6,11,15-16,26H,7-10,12H2,1-2H3,(H2,21,22)(H,23,27)
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| InChIKey |
CTHQNXLOKCRSOT-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