General Information of the Compound
| Compound ID |
CP0555951
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| Compound Name |
US9422293, 312
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| Structure |
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| Formula |
C27H27F6N5O2
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| Molecular Weight |
567.534
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| Canonical SMILES |
Cc1cc(ccc1Nc1nc(OC2CCOCC2)nc2CCN(CCc12)c1ncccc1C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C27H27F6N5O2/c1-16-15-17(26(28,29)30)4-5-21(16)35-23-19-6-11-38(24-20(27(31,32)33)3-2-10-34-24)12-7-22(19)36-25(37-23)40-18-8-13-39-14-9-18/h2-5,10,15,18H,6-9,11-14H2,1H3,(H,35,36,37)
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| InChIKey |
OMUQPDRXMAAWHR-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