General Information of the Compound
| Compound ID |
CP0091002
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| Compound Name |
(R)-6-(2-(2-methylpyrrolidin-1-yl)ethyl)-2-(1H-pyrazol-5-yl)quinoline
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| Structure |
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| Formula |
C19H22N4
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| Molecular Weight |
306.413
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1cc[nH]n1
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| InChI |
InChI=1S/C19H22N4/c1-14-3-2-11-23(14)12-9-15-4-6-17-16(13-15)5-7-18(21-17)19-8-10-20-22-19/h4-8,10,13-14H,2-3,9,11-12H2,1H3,(H,20,22)/t14-/m1/s1
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| InChIKey |
MNBLFGKPLGBLBJ-CQSZACIVSA-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