General Information of the Compound
| Compound ID |
CP0462173
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| Compound Name |
2-[1-(6,7-dimethoxyquinazolin-4-yl)piperidin-4-yl]ethanamine
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| Structure |
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| Formula |
C17H24N4O2
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| Molecular Weight |
316.405
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| Canonical SMILES |
COc1cc2ncnc(N3CCC(CCN)CC3)c2cc1OC
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| InChI |
InChI=1S/C17H24N4O2/c1-22-15-9-13-14(10-16(15)23-2)19-11-20-17(13)21-7-4-12(3-6-18)5-8-21/h9-12H,3-8,18H2,1-2H3
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| InChIKey |
RXPZCNOBZFXSDR-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