General Information of the Compound
| Compound ID |
CP0432267
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| Compound Name |
5-(1H-pyrazol-4-yl)-2-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)methyl]pyridazin-3-yl]phenol
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| Structure |
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| Formula |
C23H29N5O
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| Molecular Weight |
391.519
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| Canonical SMILES |
CC1(C)CC(Cc2ccc(nn2)-c2ccc(cc2O)-c2cn[nH]c2)CC(C)(C)N1
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| InChI |
InChI=1S/C23H29N5O/c1-22(2)11-15(12-23(3,4)28-22)9-18-6-8-20(27-26-18)19-7-5-16(10-21(19)29)17-13-24-25-14-17/h5-8,10,13-15,28-29H,9,11-12H2,1-4H3,(H,24,25)
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| InChIKey |
SJIRMWMHWILMPD-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