General Information of the Compound
| Compound ID |
CP0515151
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| Compound Name |
US9422293, 187
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| Structure |
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| Formula |
C22H24F3N7
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| Molecular Weight |
443.477
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| Canonical SMILES |
CC(C)c1nc2CCN(CCc2c(Nc2cnc(C)cn2)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C22H24F3N7/c1-13(2)19-29-17-7-10-32(21-16(22(23,24)25)5-4-8-26-21)9-6-15(17)20(31-19)30-18-12-27-14(3)11-28-18/h4-5,8,11-13H,6-7,9-10H2,1-3H3,(H,28,29,30,31)
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| InChIKey |
CSCWLSHCRJKZQR-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