General Information of the Compound
| Compound ID |
CP0559018
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| Compound Name |
N-[2-[4-(2-methylphenyl)piperazin-1-yl]-5-[2-(2-oxopyrrolidin-1-yl)ethylcarbamoyl]phenyl]furan-2-carboxamide
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| Structure |
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| Formula |
C29H33N5O4
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| Molecular Weight |
515.614
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| Canonical SMILES |
Cc1ccccc1N1CCN(CC1)c1ccc(cc1NC(=O)c1ccco1)C(=O)NCCN1CCCC1=O
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| InChI |
InChI=1S/C29H33N5O4/c1-21-6-2-3-7-24(21)32-15-17-33(18-16-32)25-11-10-22(20-23(25)31-29(37)26-8-5-19-38-26)28(36)30-12-14-34-13-4-9-27(34)35/h2-3,5-8,10-11,19-20H,4,9,12-18H2,1H3,(H,30,36)(H,31,37)
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| InChIKey |
QSHWUFNCXFOONQ-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