General Information of the Compound
| Compound ID |
CP0492557
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| Compound Name |
US9422293, 231
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| Structure |
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| Formula |
C24H21ClF6N6
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| Molecular Weight |
542.915
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2nc(nc3CCN(CCc23)c2ncccc2C(F)(F)F)N2CCC2)cc1Cl
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| InChI |
InChI=1S/C24H21ClF6N6/c25-18-13-14(4-5-16(18)23(26,27)28)33-20-15-6-11-36(21-17(24(29,30)31)3-1-8-32-21)12-7-19(15)34-22(35-20)37-9-2-10-37/h1,3-5,8,13H,2,6-7,9-12H2,(H,33,34,35)
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| InChIKey |
QRCSHXCOYUUXSF-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