General Information of the Compound
| Compound ID |
CP0567671
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| Compound Name |
(1Z,4R)-1-benzylidene-10-hydroxy-4-methyl-4H-pyrazino[2,1-b]quinazoline-3,6-dione
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| Structure |
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| Formula |
C19H15N3O3
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| Molecular Weight |
333.347
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| Canonical SMILES |
C[C@@H]1C(=O)N\C(=C/c2ccccc2)c2nc3c(O)cccc3c(=O)n12
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| InChI |
InChI=1S/C19H15N3O3/c1-11-18(24)20-14(10-12-6-3-2-4-7-12)17-21-16-13(19(25)22(11)17)8-5-9-15(16)23/h2-11,23H,1H3,(H,20,24)/b14-10-/t11-/m1/s1
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| InChIKey |
JKOZPSNPSQBQCF-UXEDPAHQSA-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