General Information of the Compound
| Compound ID |
CP0478945
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| Compound Name |
tert-butyl 4-(7-hydroxy-6-methoxyquinazolin-4-yl)piperazine-1-carboxylate
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| Structure |
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| Formula |
C18H24N4O4
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| Molecular Weight |
360.414
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| Canonical SMILES |
COc1cc2c(ncnc2cc1O)N1CCN(CC1)C(=O)OC(C)(C)C
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| InChI |
InChI=1S/C18H24N4O4/c1-18(2,3)26-17(24)22-7-5-21(6-8-22)16-12-9-15(25-4)14(23)10-13(12)19-11-20-16/h9-11,23H,5-8H2,1-4H3
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| InChIKey |
POVOVTPBLTXOPE-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