General Information of the Compound
| Compound ID |
CP0485977
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| Compound Name |
8-[1-(4-Isobutyl-phenyl)-pyrrolidin-3-yloxy]-quinolin-2-ylamine
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| Structure |
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| Formula |
C23H27N3O
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| Molecular Weight |
361.489
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| Canonical SMILES |
CC(C)Cc1ccc(cc1)N1CCC(C1)Oc1cccc2ccc(N)nc12
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| InChI |
InChI=1S/C23H27N3O/c1-16(2)14-17-6-9-19(10-7-17)26-13-12-20(15-26)27-21-5-3-4-18-8-11-22(24)25-23(18)21/h3-11,16,20H,12-15H2,1-2H3,(H2,24,25)
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| InChIKey |
UHSGLDYWKWJJLG-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