General Information of the Compound
| Compound ID |
CP0417498
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| Compound Name |
(6-(1-isopropylpiperidin-4-yloxy)-1H-indol-2-yl)(morpholino)methanone
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| Structure |
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| Formula |
C21H29N3O3
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| Molecular Weight |
371.481
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| Canonical SMILES |
CC(C)N1CCC(CC1)Oc1ccc2cc([nH]c2c1)C(=O)N1CCOCC1
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| InChI |
InChI=1S/C21H29N3O3/c1-15(2)23-7-5-17(6-8-23)27-18-4-3-16-13-20(22-19(16)14-18)21(25)24-9-11-26-12-10-24/h3-4,13-15,17,22H,5-12H2,1-2H3
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| InChIKey |
ZPDULGLPQKSFGK-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: PT01194, Histamine H3 receptor
Protein ID: PT01173, Histamine H3 receptor