General Information of the Compound
| Compound ID |
CP0079139
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| Compound Name |
N-(1-cyanocyclopropyl)-9,10-dioxoanthracene-2-sulfonamide
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| Structure |
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| Formula |
C18H12N2O4S
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| Molecular Weight |
352.371
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| Canonical SMILES |
O=C1c2ccccc2C(=O)c2cc(ccc12)S(=O)(=O)NC1(CC1)C#N
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| InChI |
InChI=1S/C18H12N2O4S/c19-10-18(7-8-18)20-25(23,24)11-5-6-14-15(9-11)17(22)13-4-2-1-3-12(13)16(14)21/h1-6,9,20H,7-8H2
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| InChIKey |
UMKGQHJIXOXUQK-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