General Information of the Compound
| Compound ID |
CP0486205
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| Compound Name |
(4-(4-(6,7-bis(2-methoxyethoxy)quinazolin-4-ylamino)-2-methylphenoxy)piperidin-1-yl)(cyclopentyl)methanone
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| Structure |
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| Formula |
C32H42N4O6
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| Molecular Weight |
578.71
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| Canonical SMILES |
COCCOc1cc2ncnc(Nc3ccc(OC4CCN(CC4)C(=O)C4CCCC4)c(C)c3)c2cc1OCCOC
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| InChI |
InChI=1S/C32H42N4O6/c1-22-18-24(8-9-28(22)42-25-10-12-36(13-11-25)32(37)23-6-4-5-7-23)35-31-26-19-29(40-16-14-38-2)30(41-17-15-39-3)20-27(26)33-21-34-31/h8-9,18-21,23,25H,4-7,10-17H2,1-3H3,(H,33,34,35)
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| InChIKey |
FGRLMKPQWLULDU-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