General Information of the Compound
| Compound ID |
CP0250211
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| Compound Name |
(7-Chloro-quinolin-4-yl)-[4-(3-piperidin-1-yl-propoxy)-phenyl]-amine; Oxalic acid
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| Structure |
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| Formula |
C23H26ClN3O
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| Molecular Weight |
395.934
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| Canonical SMILES |
Clc1ccc2c(Nc3ccc(OCCCN4CCCCC4)cc3)ccnc2c1
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| InChI |
InChI=1S/C23H26ClN3O/c24-18-5-10-21-22(11-12-25-23(21)17-18)26-19-6-8-20(9-7-19)28-16-4-15-27-13-2-1-3-14-27/h5-12,17H,1-4,13-16H2,(H,25,26)
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| InChIKey |
KQQJOBYYDOVVTN-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