General Information of the Compound
| Compound ID |
CP0666213
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| Compound Name |
6-Pyridin-4-yl-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-quinazolin-2-amine
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| Structure |
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| Formula |
C25H25N5O
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| Molecular Weight |
411.509
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| Canonical SMILES |
c1cc(-c2ccc3nc(Nc4ccc(OCCN5CCCC5)cc4)ncc3c2)ccn1
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| InChI |
InChI=1S/C25H25N5O/c1-2-14-30(13-1)15-16-31-23-6-4-22(5-7-23)28-25-27-18-21-17-20(3-8-24(21)29-25)19-9-11-26-12-10-19/h3-12,17-18H,1-2,13-16H2,(H,27,28,29)
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| InChIKey |
MMCSQTPDMRNXRC-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