General Information of the Compound
| Compound ID |
CP0372300
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| Compound Name |
2-N-(2,6-dichlorophenyl)-4-N-[4-(trifluoromethyl)phenyl]-1,3-benzothiazole-2,4-diamine
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| Structure |
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| Formula |
C20H12Cl2F3N3S
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| Molecular Weight |
454.304
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2cccc3sc(Nc4c(Cl)cccc4Cl)nc23)cc1
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| InChI |
InChI=1S/C20H12Cl2F3N3S/c21-13-3-1-4-14(22)17(13)27-19-28-18-15(5-2-6-16(18)29-19)26-12-9-7-11(8-10-12)20(23,24)25/h1-10,26H,(H,27,28)
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| InChIKey |
DRSOXCMNFQYUTQ-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: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1