General Information of the Compound
| Compound ID |
CP0289796
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| Compound Name |
(7-Chloro-quinolin-4-yl)-(8-piperidin-1-yl-octyl)-amine; Oxalic acid
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| Structure |
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| Formula |
C22H32ClN3
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| Molecular Weight |
373.972
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| Canonical SMILES |
Clc1ccc2c(NCCCCCCCCN3CCCCC3)ccnc2c1
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| InChI |
InChI=1S/C22H32ClN3/c23-19-10-11-20-21(12-14-25-22(20)18-19)24-13-6-3-1-2-4-7-15-26-16-8-5-9-17-26/h10-12,14,18H,1-9,13,15-17H2,(H,24,25)
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| InChIKey |
HOHHBBVPNOOKBH-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