General Information of the Compound
| Compound ID |
CP0434182
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| Compound Name |
(5-chloro-1H-indol-2-yl)-[4-(2-pyridin-3-yloxyethyl)piperazin-1-yl]methanone
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| Structure |
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| Formula |
C20H21ClN4O2
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| Molecular Weight |
384.867
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| Canonical SMILES |
Clc1ccc2[nH]c(cc2c1)C(=O)N1CCN(CCOc2cccnc2)CC1
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| InChI |
InChI=1S/C20H21ClN4O2/c21-16-3-4-18-15(12-16)13-19(23-18)20(26)25-8-6-24(7-9-25)10-11-27-17-2-1-5-22-14-17/h1-5,12-14,23H,6-11H2
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| InChIKey |
WLZJPWTZSKWVGS-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: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor