General Information of the Compound
| Compound ID |
CP0553317
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| Compound Name |
N-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]amino]ethoxy]ethoxy]ethyl]-4,9-dioxobenzo[f][1]benzofuran-2-carboxamide
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| Formula |
C32H28N4O10
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| Molecular Weight |
628.594
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| Canonical SMILES |
O=C(NCCOCCOCCNc1ccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c2c1)c1cc2c(o1)C(=O)c1ccccc1C2=O
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| InChI |
InChI=1S/C32H28N4O10/c37-25-8-7-23(29(40)35-25)36-31(42)20-6-5-17(15-21(20)32(36)43)33-9-11-44-13-14-45-12-10-34-30(41)24-16-22-26(38)18-3-1-2-4-19(18)27(39)28(22)46-24/h1-6,15-16,23,33H,7-14H2,(H,34,41)(H,35,37,40)
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| InChIKey |
XHIXVAPOWPNHBP-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