General Information of the Compound
| Compound ID |
CP0861683
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| Compound Name |
(Z)-1-(4-fluorophenyl)-4-(4-pyridin-2-ylpiperazin-1-yl)butan-1-one oxime
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| Structure |
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| Formula |
C19H23FN4O
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| Molecular Weight |
342.418
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| Canonical SMILES |
O/N=C(/CCCN1CCN(c2ccccn2)CC1)c1ccc(F)cc1
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| InChI |
InChI=1S/C19H23FN4O/c20-17-8-6-16(7-9-17)18(22-25)4-3-11-23-12-14-24(15-13-23)19-5-1-2-10-21-19/h1-2,5-10,25H,3-4,11-15H2/b22-18-
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| InChIKey |
JTFASLDIMUTFOK-PYCFMQQDSA-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