General Information of the Compound
| Compound ID |
CP0474816
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| Compound Name |
US9422293, 337
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| Structure |
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| Formula |
C26H25F6N5O
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| Molecular Weight |
537.508
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2nc(OC3CCCC3)nc3CCN(CCc23)c2ncccc2C(F)(F)F)cc1
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| InChI |
InChI=1S/C26H25F6N5O/c27-25(28,29)16-7-9-17(10-8-16)34-22-19-11-14-37(23-20(26(30,31)32)6-3-13-33-23)15-12-21(19)35-24(36-22)38-18-4-1-2-5-18/h3,6-10,13,18H,1-2,4-5,11-12,14-15H2,(H,34,35,36)
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| InChIKey |
PILDOZPFMIVERW-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