General Information of the Compound
| Compound ID |
CP0954939
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| Compound Name |
7-[Pyridin-2-yl-(4-pyridin-2-yl-piperazin-1-yl)-methyl]-quinolin-8-ol
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| Structure |
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| Formula |
C24H23N5O
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| Molecular Weight |
397.482
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| Canonical SMILES |
Oc1c(C(c2ccccn2)N2CCN(c3ccccn3)CC2)ccc2cccnc12
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| InChI |
InChI=1S/C24H23N5O/c30-24-19(10-9-18-6-5-13-27-22(18)24)23(20-7-1-3-11-25-20)29-16-14-28(15-17-29)21-8-2-4-12-26-21/h1-13,23,30H,14-17H2
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| InChIKey |
OZSANKKZTCLFJI-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