General Information of the Compound
| Compound ID |
CP0378973
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| Compound Name |
2-N-[4-(aminomethyl)-2,6-dichlorophenyl]-7-N-[4-(trifluoromethyl)phenyl]-[1,3]thiazolo[5,4-d]pyrimidine-2,7-diamine
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| Structure |
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| Formula |
C19H13Cl2F3N6S
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| Molecular Weight |
485.322
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| Canonical SMILES |
NCc1cc(Cl)c(Nc2nc3c(Nc4ccc(cc4)C(F)(F)F)ncnc3s2)c(Cl)c1
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| InChI |
InChI=1S/C19H13Cl2F3N6S/c20-12-5-9(7-25)6-13(21)14(12)29-18-30-15-16(26-8-27-17(15)31-18)28-11-3-1-10(2-4-11)19(22,23)24/h1-6,8H,7,25H2,(H,29,30)(H,26,27,28)
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| InChIKey |
YKIBKPIRIJNMKG-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