General Information of the Compound
| Compound ID |
CP0515437
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| Compound Name |
US9422293, 173
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| Structure |
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| Formula |
C26H19ClF6N6
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| Molecular Weight |
564.921
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2nc(nc3CCN(CCc23)c2ncccc2C(F)(F)F)-c2ccccn2)cc1Cl
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| InChI |
InChI=1S/C26H19ClF6N6/c27-19-14-15(6-7-17(19)25(28,29)30)36-22-16-8-12-39(24-18(26(31,32)33)4-3-11-35-24)13-9-20(16)37-23(38-22)21-5-1-2-10-34-21/h1-7,10-11,14H,8-9,12-13H2,(H,36,37,38)
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| InChIKey |
ZCYLSZBFHIVLMS-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: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1