General Information of the Compound
| Compound ID |
CP0860027
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| Compound Name |
(E)-3-(4-pyridin-2-ylpiperazin-1-yl)-1-(m-tolyl)propan-1-one oxime
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| Structure |
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| Formula |
C19H24N4O
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| Molecular Weight |
324.428
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| Canonical SMILES |
Cc1cccc(/C(CCN2CCN(c3ccccn3)CC2)=N/O)c1
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| InChI |
InChI=1S/C19H24N4O/c1-16-5-4-6-17(15-16)18(21-24)8-10-22-11-13-23(14-12-22)19-7-2-3-9-20-19/h2-7,9,15,24H,8,10-14H2,1H3/b21-18+
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| InChIKey |
NHFACONALCKCDS-DYTRJAOYSA-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