General Information of the Compound
| Compound ID |
CP0497316
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| Compound Name |
N-[5-[4-[(4-acetamidophenyl)methyl]piperazin-1-yl]-2-propan-2-yloxyphenyl]pyrazine-2-carboxamide
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| Structure |
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| Formula |
C27H32N6O3
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| Molecular Weight |
488.592
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| Canonical SMILES |
CC(C)Oc1ccc(cc1NC(=O)c1cnccn1)N1CCN(Cc2ccc(NC(C)=O)cc2)CC1
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| InChI |
InChI=1S/C27H32N6O3/c1-19(2)36-26-9-8-23(16-24(26)31-27(35)25-17-28-10-11-29-25)33-14-12-32(13-15-33)18-21-4-6-22(7-5-21)30-20(3)34/h4-11,16-17,19H,12-15,18H2,1-3H3,(H,30,34)(H,31,35)
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| InChIKey |
BRNQFKDKHNCFRL-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