General Information of the Compound
| Compound ID |
CP0495308
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| Compound Name |
US9422293, 245
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| Structure |
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| Formula |
C26H25ClF6N6O
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| Molecular Weight |
586.968
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2nc(nc3CCN(CCc23)c2ncccc2C(F)(F)F)N2CCCOCC2)cc1Cl
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| InChI |
InChI=1S/C26H25ClF6N6O/c27-20-15-16(4-5-18(20)25(28,29)30)35-22-17-6-10-38(23-19(26(31,32)33)3-1-8-34-23)11-7-21(17)36-24(37-22)39-9-2-13-40-14-12-39/h1,3-5,8,15H,2,6-7,9-14H2,(H,35,36,37)
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| InChIKey |
DQDRNFJGVWIVRX-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