General Information of the Compound
| Compound ID |
CP0470147
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| Compound Name |
N-[3-[3-[2-[(dimethylamino)methyl]phenyl]pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C29H24F3N5O
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| Molecular Weight |
515.539
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| Canonical SMILES |
CN(C)Cc1ccccc1-c1cnn2c(ccnc12)-c1cccc(NC(=O)c2cccc(c2)C(F)(F)F)c1
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| InChI |
InChI=1S/C29H24F3N5O/c1-36(2)18-21-7-3-4-12-24(21)25-17-34-37-26(13-14-33-27(25)37)19-8-6-11-23(16-19)35-28(38)20-9-5-10-22(15-20)29(30,31)32/h3-17H,18H2,1-2H3,(H,35,38)
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| InChIKey |
ZREJACCVQDDLSA-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