General Information of the Compound
| Compound ID |
CP0445126
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| Compound Name |
US9422293, 153
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| Structure |
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| Formula |
C26H21F6N5S
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| Molecular Weight |
549.544
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| Canonical SMILES |
Cc1cc(cs1)-c1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C26H21F6N5S/c1-15-13-16(14-38-15)22-35-21-9-12-37(24-20(26(30,31)32)3-2-10-33-24)11-8-19(21)23(36-22)34-18-6-4-17(5-7-18)25(27,28)29/h2-7,10,13-14H,8-9,11-12H2,1H3,(H,34,35,36)
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| InChIKey |
IXWKCYCMWHWTRK-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