General Information of the Compound
| Compound ID |
CP0561516
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| Compound Name |
4-[2-methyl-3-(3-oxo-1H-isoindol-2-yl)phenyl]-7-(4-methylpiperazine-1-carbonyl)-9H-carbazole-1-carboxamide
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| Structure |
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| Formula |
C34H31N5O3
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| Molecular Weight |
557.654
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| Canonical SMILES |
CN1CCN(CC1)C(=O)c1ccc2c(c1)[nH]c1c(ccc(-c3cccc(N4Cc5ccccc5C4=O)c3C)c21)C(N)=O
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| InChI |
InChI=1S/C34H31N5O3/c1-20-23(8-5-9-29(20)39-19-22-6-3-4-7-24(22)34(39)42)25-12-13-27(32(35)40)31-30(25)26-11-10-21(18-28(26)36-31)33(41)38-16-14-37(2)15-17-38/h3-13,18,36H,14-17,19H2,1-2H3,(H2,35,40)
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| InChIKey |
PGFUCYYXBTYNNS-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