General Information of the Compound
| Compound ID |
CP0470149
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| Compound Name |
N-[3-[3-[5-(pyrrolidin-1-ylmethyl)furan-3-yl]pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C29H24F3N5O2
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| Molecular Weight |
531.538
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| Canonical SMILES |
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)-c1ccnc2c(cnn12)-c1coc(CN2CCCC2)c1
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| InChI |
InChI=1S/C29H24F3N5O2/c30-29(31,32)22-7-3-6-20(13-22)28(38)35-23-8-4-5-19(14-23)26-9-10-33-27-25(16-34-37(26)27)21-15-24(39-18-21)17-36-11-1-2-12-36/h3-10,13-16,18H,1-2,11-12,17H2,(H,35,38)
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| InChIKey |
UXWQKBQYLIAPJN-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