General Information of the Compound
| Compound ID |
CP0491037
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| Compound Name |
(4-isopropylpiperazin-1-yl)(6-phenoxypyridin-3-yl)methanone
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| Structure |
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| Formula |
C19H23N3O2
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| Molecular Weight |
325.412
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| Canonical SMILES |
CC(C)N1CCN(CC1)C(=O)c1ccc(Oc2ccccc2)nc1
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| InChI |
InChI=1S/C19H23N3O2/c1-15(2)21-10-12-22(13-11-21)19(23)16-8-9-18(20-14-16)24-17-6-4-3-5-7-17/h3-9,14-15H,10-13H2,1-2H3
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| InChIKey |
OLELQSFJQQFHFK-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