General Information of the Compound
| Compound ID |
CP0308309
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| Compound Name |
2-methyl-N-[2-(4-sulfamoylanilino)-5,6-dihydrobenzo[h]quinazolin-8-yl]propanamide
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| Structure |
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| Formula |
C22H23N5O3S
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| Molecular Weight |
437.525
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| Canonical SMILES |
CC(C)C(=O)Nc1ccc-2c(CCc3cnc(Nc4ccc(cc4)S(N)(=O)=O)nc-23)c1
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| InChI |
InChI=1S/C22H23N5O3S/c1-13(2)21(28)25-17-7-10-19-14(11-17)3-4-15-12-24-22(27-20(15)19)26-16-5-8-18(9-6-16)31(23,29)30/h5-13H,3-4H2,1-2H3,(H,25,28)(H2,23,29,30)(H,24,26,27)
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| InChIKey |
RWLKOGVBOMMSBN-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