General Information of the Compound
| Compound ID |
CP0481147
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| Compound Name |
US9422293, 227
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| Structure |
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| Formula |
C26H30Cl2F3N7
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| Molecular Weight |
568.475
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| Canonical SMILES |
CN(C)CCN(C)c1nc2CCN(CCc2c(NCc2ccc(Cl)c(Cl)c2)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C26H30Cl2F3N7/c1-36(2)13-14-37(3)25-34-22-9-12-38(24-19(26(29,30)31)5-4-10-32-24)11-8-18(22)23(35-25)33-16-17-6-7-20(27)21(28)15-17/h4-7,10,15H,8-9,11-14,16H2,1-3H3,(H,33,34,35)
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| InChIKey |
NRQVNZNTKUIERA-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