General Information of the Compound
| Compound ID |
CP0519866
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| Compound Name |
N-[2-(3,5-dimethylpyrazol-1-yl)-6-[3-(1-methylpiperidin-4-yl)oxyphenyl]pyrimidin-4-yl]acetamide
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| Structure |
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| Formula |
C23H28N6O2
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| Molecular Weight |
420.517
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| Canonical SMILES |
CN1CCC(CC1)Oc1cccc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C
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| InChI |
InChI=1S/C23H28N6O2/c1-15-12-16(2)29(27-15)23-25-21(14-22(26-23)24-17(3)30)18-6-5-7-20(13-18)31-19-8-10-28(4)11-9-19/h5-7,12-14,19H,8-11H2,1-4H3,(H,24,25,26,30)
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| InChIKey |
SUAVPMVHEWSQAQ-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