General Information of the Compound
| Compound ID |
CP0418161
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| Compound Name |
N-(2-methylsulfonylethyl)-12-oxo-12H-benzo[g]pyrido[2,1-b]quinazoline-4-carboxamide
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| Structure |
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| Formula |
C20H17N3O4S
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| Molecular Weight |
395.44
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| Canonical SMILES |
CS(=O)(=O)CCNC(=O)c1cccn2c1nc1cc3ccccc3cc1c2=O
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| InChI |
InChI=1S/C20H17N3O4S/c1-28(26,27)10-8-21-19(24)15-7-4-9-23-18(15)22-17-12-14-6-3-2-5-13(14)11-16(17)20(23)25/h2-7,9,11-12H,8,10H2,1H3,(H,21,24)
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| InChIKey |
HVPNYGPYDGPRDO-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