General Information of the Compound
| Compound ID |
CP0227676
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| Compound Name |
2-cyclopropyl-6,7-dimethoxy-4-[4-(2-methoxyphenyl)piperidin-1-yl]quinazoline
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| Structure |
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| Formula |
C25H29N3O3
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| Molecular Weight |
419.525
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| Canonical SMILES |
COc1cc2nc(nc(N3CCC(CC3)c3ccccc3OC)c2cc1OC)C1CC1
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| InChI |
InChI=1S/C25H29N3O3/c1-29-21-7-5-4-6-18(21)16-10-12-28(13-11-16)25-19-14-22(30-2)23(31-3)15-20(19)26-24(27-25)17-8-9-17/h4-7,14-17H,8-13H2,1-3H3
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| InChIKey |
KSEPWCUCBVMLMT-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