General Information of the Compound
| Compound ID |
CP0478093
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| Compound Name |
US9452986, 14
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| Structure |
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| Formula |
C20H18F2N4O2
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| Molecular Weight |
384.386
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| Canonical SMILES |
FC(F)c1ccc(Oc2ccc3nc(ccc3c2)C(=O)N2CCNCC2)nc1
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| InChI |
InChI=1S/C20H18F2N4O2/c21-19(22)14-2-6-18(24-12-14)28-15-3-5-16-13(11-15)1-4-17(25-16)20(27)26-9-7-23-8-10-26/h1-6,11-12,19,23H,7-10H2
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| InChIKey |
XJNLQAUECWCBNY-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
Protein ID: PT02752, Sodium channel protein type 10 subunit alpha
Protein ID: PT03022, Sodium channel protein type 2 subunit alpha
Protein ID: PT01105, Sodium channel protein type 5 subunit alpha
Protein ID: PT05769, Sodium channel protein type 7 subunit alpha
Protein ID: PT01000, Sodium channel protein type 9 subunit alpha