General Information of the Compound
| Compound ID |
CP0343075
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| Compound Name |
2-(4-chlorophenoxy)-N-[4-methyl-2-(4-pyrrolidin-1-ylpiperidin-1-yl)quinazolin-6-yl]propanamide
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| Structure |
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| Formula |
C27H32ClN5O2
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| Molecular Weight |
494.039
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| Canonical SMILES |
CC(Oc1ccc(Cl)cc1)C(=O)Nc1ccc2nc(nc(C)c2c1)N1CCC(CC1)N1CCCC1
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| InChI |
InChI=1S/C27H32ClN5O2/c1-18-24-17-21(30-26(34)19(2)35-23-8-5-20(28)6-9-23)7-10-25(24)31-27(29-18)33-15-11-22(12-16-33)32-13-3-4-14-32/h5-10,17,19,22H,3-4,11-16H2,1-2H3,(H,30,34)
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| InChIKey |
PQPMJTCWFPFGAC-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