General Information of the Compound
| Compound ID |
CP0579947
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| Compound Name |
3-amino-6-[4-[(dimethylamino)methyl]phenyl]-N-propan-2-ylpyrazine-2-carboxamide
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| Structure |
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| Formula |
C17H23N5O
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| Molecular Weight |
313.405
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| Canonical SMILES |
CC(C)NC(=O)c1nc(cnc1N)-c1ccc(CN(C)C)cc1
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| InChI |
InChI=1S/C17H23N5O/c1-11(2)20-17(23)15-16(18)19-9-14(21-15)13-7-5-12(6-8-13)10-22(3)4/h5-9,11H,10H2,1-4H3,(H2,18,19)(H,20,23)
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| InChIKey |
AUCLKLPCRFKTBY-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