General Information of the Compound
| Compound ID |
CP0478609
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| Compound Name |
US9193726, 25
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| Structure |
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| Formula |
C24H24F2N4O2
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| Molecular Weight |
438.478
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| Canonical SMILES |
Cc1cn(cn1)-c1ccc2C(=O)N(CCn2c1=O)[C@@H]1CCC[C@@H]1Cc1cc(F)cc(F)c1
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| InChI |
InChI=1S/C24H24F2N4O2/c1-15-13-28(14-27-15)21-5-6-22-24(32)29(7-8-30(22)23(21)31)20-4-2-3-17(20)9-16-10-18(25)12-19(26)11-16/h5-6,10-14,17,20H,2-4,7-9H2,1H3/t17-,20-/m1/s1
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| InChIKey |
RPJNOQYNBJHDOW-YLJYHZDGSA-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