General Information of the Compound
| Compound ID |
CP0364821
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| Compound Name |
8-[(3-carbamoylquinolin-8-yl)disulfanyl]quinoline-3-carboxamide
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| Structure |
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| Formula |
C20H14N4O2S2
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| Molecular Weight |
406.492
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| Canonical SMILES |
NC(=O)c1cnc2c(SSc3cccc4cc(cnc34)C(N)=O)cccc2c1
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| InChI |
InChI=1S/C20H14N4O2S2/c21-19(25)13-7-11-3-1-5-15(17(11)23-9-13)27-28-16-6-2-4-12-8-14(20(22)26)10-24-18(12)16/h1-10H,(H2,21,25)(H2,22,26)
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| InChIKey |
PYKBGJHTBCZDGQ-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