General Information of the Compound
| Compound ID |
CP0491955
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| Compound Name |
8-((S)-1-Benzyl-pyrrolidin-3-yloxy)-quinolin-2-ylamine
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| Structure |
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| Formula |
C20H21N3O
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| Molecular Weight |
319.408
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| Canonical SMILES |
Nc1ccc2cccc(O[C@H]3CCN(Cc4ccccc4)C3)c2n1
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| InChI |
InChI=1S/C20H21N3O/c21-19-10-9-16-7-4-8-18(20(16)22-19)24-17-11-12-23(14-17)13-15-5-2-1-3-6-15/h1-10,17H,11-14H2,(H2,21,22)/t17-/m0/s1
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| InChIKey |
RHJVYTFUGSPPAA-KRWDZBQOSA-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