General Information of the Compound
| Compound ID |
CP0502987
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| Compound Name |
1-[1-[6-methyl-1-(2-methyl-4-propan-2-yloxyphenyl)-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]imidazolidin-2-one
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| Structure |
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| Formula |
C24H28N6O2
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| Molecular Weight |
432.528
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| Canonical SMILES |
CC(C)Oc1ccc(N2CCc3c2nc(C)cc3-n2ccc(n2)N2CCNC2=O)c(C)c1
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| InChI |
InChI=1S/C24H28N6O2/c1-15(2)32-18-5-6-20(16(3)13-18)28-10-7-19-21(14-17(4)26-23(19)28)30-11-8-22(27-30)29-12-9-25-24(29)31/h5-6,8,11,13-15H,7,9-10,12H2,1-4H3,(H,25,31)
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| InChIKey |
LFNSPSSAJSBXMS-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