General Information of the Compound
| Compound ID |
CP0478977
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| Compound Name |
1-(3-naphthalen-2-yloxypropyl)-4-pyridin-4-ylpiperazine
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| Formula |
C22H25N3O
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| Molecular Weight |
347.462
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| Canonical SMILES |
C(COc1ccc2ccccc2c1)CN1CCN(CC1)c1ccncc1
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| InChI |
InChI=1S/C22H25N3O/c1-2-5-20-18-22(7-6-19(20)4-1)26-17-3-12-24-13-15-25(16-14-24)21-8-10-23-11-9-21/h1-2,4-11,18H,3,12-17H2
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| InChIKey |
PNHJCOHIEQSSKV-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