General Information of the Compound
| Compound ID |
CP0480155
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| Compound Name |
N-[3-[3-[6-(4-methylpiperazin-1-yl)pyridin-3-yl]pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C30H26F3N7O
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| Molecular Weight |
557.58
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| Canonical SMILES |
CN1CCN(CC1)c1ccc(cn1)-c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
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| InChI |
InChI=1S/C30H26F3N7O/c1-38-12-14-39(15-13-38)27-9-8-22(18-35-27)25-19-36-40-26(10-11-34-28(25)40)20-4-3-7-24(17-20)37-29(41)21-5-2-6-23(16-21)30(31,32)33/h2-11,16-19H,12-15H2,1H3,(H,37,41)
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| InChIKey |
DNDVGFIEWOHGAH-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