General Information of the Compound
| Compound ID |
CP0314384
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| Compound Name |
7-[[4-(2,2,2-trifluoroethylamino)furo[3,2-d]pyrimidin-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
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| Structure |
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| Formula |
C17H14F3N5O2
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| Molecular Weight |
377.326
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| Canonical SMILES |
FC(F)(F)CNc1nc(Nc2ccc3CCC(=O)Nc3c2)nc2ccoc12
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| InChI |
InChI=1S/C17H14F3N5O2/c18-17(19,20)8-21-15-14-11(5-6-27-14)24-16(25-15)22-10-3-1-9-2-4-13(26)23-12(9)7-10/h1,3,5-7H,2,4,8H2,(H,23,26)(H2,21,22,24,25)
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| InChIKey |
WSFYPKMMFQPXHF-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