General Information of the Compound
| Compound ID |
CP0572894
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| Compound Name |
N,3-dimethyl-5-[6-[(3S)-oxolan-3-yl]oxy-7-(1-propan-2-ylpyrazol-4-yl)imidazo[1,2-b]pyridazin-3-yl]benzamide
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| Structure |
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| Formula |
C25H28N6O3
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| Molecular Weight |
460.538
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| Canonical SMILES |
CNC(=O)c1cc(C)cc(c1)-c1cnc2cc(-c3cnn(c3)C(C)C)c(O[C@H]3CCOC3)nn12
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| InChI |
InChI=1S/C25H28N6O3/c1-15(2)30-13-19(11-28-30)21-10-23-27-12-22(17-7-16(3)8-18(9-17)24(32)26-4)31(23)29-25(21)34-20-5-6-33-14-20/h7-13,15,20H,5-6,14H2,1-4H3,(H,26,32)/t20-/m0/s1
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| InChIKey |
QJSDPLBJLHJTJP-FQEVSTJZSA-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