General Information of the Compound
| Compound ID |
CP0522742
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| Compound Name |
N-[2-(3,5-dimethylpyrazol-1-yl)-6-[3-(1-propan-2-ylpyrrolidin-3-yl)oxyphenyl]pyrimidin-4-yl]acetamide
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| Structure |
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| Formula |
C24H30N6O2
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| Molecular Weight |
434.544
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| Canonical SMILES |
CC(C)N1CCC(C1)Oc1cccc(c1)-c1cc(NC(C)=O)nc(n1)-n1nc(C)cc1C
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| InChI |
InChI=1S/C24H30N6O2/c1-15(2)29-10-9-21(14-29)32-20-8-6-7-19(12-20)22-13-23(25-18(5)31)27-24(26-22)30-17(4)11-16(3)28-30/h6-8,11-13,15,21H,9-10,14H2,1-5H3,(H,25,26,27,31)
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| InChIKey |
UAVPYOCGCXNBPX-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