General Information of the Compound
| Compound ID |
CP0315052
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| Compound Name |
4-(5,6-dihydrobenzo[h]quinazolin-2-ylamino)benzenesulfonamide
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| Structure |
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| Formula |
C18H16N4O2S
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| Molecular Weight |
352.419
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| Canonical SMILES |
NS(=O)(=O)c1ccc(Nc2ncc3CCc4ccccc4-c3n2)cc1
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| InChI |
InChI=1S/C18H16N4O2S/c19-25(23,24)15-9-7-14(8-10-15)21-18-20-11-13-6-5-12-3-1-2-4-16(12)17(13)22-18/h1-4,7-11H,5-6H2,(H2,19,23,24)(H,20,21,22)
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| InChIKey |
HVDBCHMIMRDBOY-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