General Information of the Compound
| Compound ID |
CP0436225
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| Compound Name |
N-[1-(3-pyridin-3-ylpropanoyl)piperidin-4-yl]-9,10-dihydroanthracene-9-carboxamide
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| Structure |
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| Formula |
C28H29N3O2
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| Molecular Weight |
439.559
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| Canonical SMILES |
O=C(CCc1cccnc1)N1CCC(CC1)NC(=O)C1c2ccccc2Cc2ccccc12
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| InChI |
InChI=1S/C28H29N3O2/c32-26(12-11-20-6-5-15-29-19-20)31-16-13-23(14-17-31)30-28(33)27-24-9-3-1-7-21(24)18-22-8-2-4-10-25(22)27/h1-10,15,19,23,27H,11-14,16-18H2,(H,30,33)
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| InChIKey |
XECZPCIJAUSKAY-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