General Information of the Compound
| Compound ID |
CP0480319
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| Compound Name |
2-N-(2,6-dichlorophenyl)-5-(4-propan-2-ylpiperazin-1-yl)-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 |
C25H24Cl2F3N7S
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| Molecular Weight |
582.483
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| Canonical SMILES |
CC(C)N1CCN(CC1)c1nc(Nc2ccc(cc2)C(F)(F)F)c2nc(Nc3c(Cl)cccc3Cl)sc2n1
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| InChI |
InChI=1S/C25H24Cl2F3N7S/c1-14(2)36-10-12-37(13-11-36)23-34-21(31-16-8-6-15(7-9-16)25(28,29)30)20-22(35-23)38-24(33-20)32-19-17(26)4-3-5-18(19)27/h3-9,14H,10-13H2,1-2H3,(H,32,33)(H,31,34,35)
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| InChIKey |
HQZDRXPOOGVWGR-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