General Information of the Compound
| Compound ID |
CP0484693
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| Compound Name |
[4-[(3-chloro-4-piperidin-4-yloxyphenyl)methyl]piperazin-1-yl]-(5-phenylfuran-2-yl)methanone
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| Structure |
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| Formula |
C27H30ClN3O3
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| Molecular Weight |
480.008
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| Canonical SMILES |
Clc1cc(CN2CCN(CC2)C(=O)c2ccc(o2)-c2ccccc2)ccc1OC1CCNCC1
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| InChI |
InChI=1S/C27H30ClN3O3/c28-23-18-20(6-7-25(23)33-22-10-12-29-13-11-22)19-30-14-16-31(17-15-30)27(32)26-9-8-24(34-26)21-4-2-1-3-5-21/h1-9,18,22,29H,10-17,19H2
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| InChIKey |
KNGKMDYIAHOGSZ-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