General Information of the Compound
| Compound ID |
CP0390762
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| Compound Name |
N-[5-[1-[[4-(diethylamino)phenyl]methyl]piperidin-4-yl]-2-ethoxyphenyl]pyrazine-2-carboxamide
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| Structure |
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| Formula |
C29H37N5O2
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| Molecular Weight |
487.648
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| Canonical SMILES |
CCOc1ccc(cc1NC(=O)c1cnccn1)C1CCN(Cc2ccc(cc2)N(CC)CC)CC1
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| InChI |
InChI=1S/C29H37N5O2/c1-4-34(5-2)25-10-7-22(8-11-25)21-33-17-13-23(14-18-33)24-9-12-28(36-6-3)26(19-24)32-29(35)27-20-30-15-16-31-27/h7-12,15-16,19-20,23H,4-6,13-14,17-18,21H2,1-3H3,(H,32,35)
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| InChIKey |
OUHNIKHVHCIKKY-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