General Information of the Compound
| Compound ID |
CP0460716
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| Compound Name |
1-(4-chloro-3-(trifluoromethyl)phenyl)-3-(2,3-dibromo-7-hydroxynaphthalen-1-yl)urea
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| Structure |
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| Formula |
C18H10Br2ClF3N2O2
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| Molecular Weight |
538.545
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| Canonical SMILES |
Oc1ccc2cc(Br)c(Br)c(NC(=O)Nc3ccc(Cl)c(c3)C(F)(F)F)c2c1
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| InChI |
InChI=1S/C18H10Br2ClF3N2O2/c19-13-5-8-1-3-10(27)7-11(8)16(15(13)20)26-17(28)25-9-2-4-14(21)12(6-9)18(22,23)24/h1-7,27H,(H2,25,26,28)
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| InChIKey |
BNMSZBXOWFIYPX-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