General Information of the Compound
| Compound ID |
CP0849209
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| Compound Name |
(E)-2-methoxy-3-(4-pyridin-2-ylpiperazin-1-yl)-1-(m-tolyl)-propan-1-one O-methyloxime
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| Structure |
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| Formula |
C20H26N4O2
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| Molecular Weight |
354.454
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| Canonical SMILES |
COC(CN1CCN(c2ccccn2)CC1)/C(=N/O)c1cccc(C)c1
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| InChI |
InChI=1S/C20H26N4O2/c1-16-6-5-7-17(14-16)20(22-25)18(26-2)15-23-10-12-24(13-11-23)19-8-3-4-9-21-19/h3-9,14,18,25H,10-13,15H2,1-2H3/b22-20+
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| InChIKey |
CRPDSGPIDWBZJJ-LSDHQDQOSA-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: PT01161, D(4) dopamine receptor