General Information of the Compound
| Compound ID |
CP0473294
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| Compound Name |
3,5-dimethoxy-N-[5-(4-methylpiperazin-1-yl)-4-phenyl-1,3-thiazol-2-yl]benzamide;dihydrochloride
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| Structure |
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| Formula |
C23H28Cl2N4O3S
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| Molecular Weight |
511.475
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| Canonical SMILES |
Cl.Cl.COc1cc(OC)cc(c1)C(=O)Nc1nc(c(s1)N1CCN(C)CC1)-c1ccccc1
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| InChI |
InChI=1S/C23H26N4O3S.2ClH/c1-26-9-11-27(12-10-26)22-20(16-7-5-4-6-8-16)24-23(31-22)25-21(28)17-13-18(29-2)15-19(14-17)30-3;;/h4-8,13-15H,9-12H2,1-3H3,(H,24,25,28);2*1H
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| InChIKey |
YGUQEULFWZZJPN-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: PT04567, Transient receptor potential cation channel subfamily V member 4
Protein ID: PT03081, Transient receptor potential cation channel subfamily V member 4