General Information of the Compound
| Compound ID |
CP0870344
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| Compound Name |
N-(4-(4-(6-butylquinolin-8-yloxy)piperidin-1-yl)butyl)cyclohexanesulfonamide dihydrochloride
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| Structure |
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| Formula |
C28H45Cl2N3O3S
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| Molecular Weight |
574.659
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| Canonical SMILES |
CCCCc1cc(OC2CCN(CCCCNS(=O)(=O)C3CCCCC3)CC2)c2ncccc2c1.Cl.Cl
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| InChI |
InChI=1S/C28H43N3O3S.2ClH/c1-2-3-10-23-21-24-11-9-16-29-28(24)27(22-23)34-25-14-19-31(20-15-25)18-8-7-17-30-35(32,33)26-12-5-4-6-13-26;;/h9,11,16,21-22,25-26,30H,2-8,10,12-15,17-20H2,1H3;2*1H
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| InChIKey |
NHUMGVCVHNLSDY-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
Protein ID: PT01206, Histamine H1 receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2