General Information of the Compound
| Compound ID |
CP0091001
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| Compound Name |
(R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinolin-2-yl)-4,5-dihydrothiazole
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| Structure |
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| Formula |
C19H23N3S
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| Molecular Weight |
325.481
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| Canonical SMILES |
C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)C1=NCCS1
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| InChI |
InChI=1S/C19H23N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,13-14H,2-3,8-12H2,1H3/t14-/m1/s1
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| InChIKey |
CQOZCJAFTZEIHN-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