General Information of the Compound
| Compound ID |
CP0958090
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| Compound Name |
7-[(4-Methyl-piperazin-1-yl)-pyridin-2-yl-methyl]-quinolin-8-ol
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| Structure |
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| Formula |
C20H22N4O
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| Molecular Weight |
334.423
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| Canonical SMILES |
CN1CCN(C(c2ccccn2)c2ccc3cccnc3c2O)CC1
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| InChI |
InChI=1S/C20H22N4O/c1-23-11-13-24(14-12-23)19(17-6-2-3-9-21-17)16-8-7-15-5-4-10-22-18(15)20(16)25/h2-10,19,25H,11-14H2,1H3
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| InChIKey |
BFFBQQGTYYGIFR-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