General Information of the Compound
| Compound ID |
CP0425151
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| Compound Name |
8-[1-(2-Benzo[1,3]dioxol-5-yl-1-methyl-ethyl)-pyrrolidin-3-yloxy]-quinolin-2-ylamine
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| Structure |
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| Formula |
C23H25N3O3
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| Molecular Weight |
391.471
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| Canonical SMILES |
CC(Cc1ccc2OCOc2c1)N1CCC(C1)Oc1cccc2ccc(N)nc12
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| InChI |
InChI=1S/C23H25N3O3/c1-15(11-16-5-7-19-21(12-16)28-14-27-19)26-10-9-18(13-26)29-20-4-2-3-17-6-8-22(24)25-23(17)20/h2-8,12,15,18H,9-11,13-14H2,1H3,(H2,24,25)
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| InChIKey |
OUVJHWNDXJXEKN-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