General Information of the Compound
| Compound ID |
CP0523499
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| Compound Name |
1-(2,5-dichlorophenyl)-8-methoxy-3-methylimidazo[5,1-c][1,2,4]benzotriazine
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| Structure |
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| Formula |
C17H12Cl2N4O
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| Molecular Weight |
359.216
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| Canonical SMILES |
COc1ccc2nnc3c(C)nc(-c4cc(Cl)ccc4Cl)n3c2c1
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| InChI |
InChI=1S/C17H12Cl2N4O/c1-9-16-22-21-14-6-4-11(24-2)8-15(14)23(16)17(20-9)12-7-10(18)3-5-13(12)19/h3-8H,1-2H3
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| InChIKey |
VSPLHWROJCSRNJ-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: PT01875, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A
Protein ID: PT02047, cGMP-dependent 3',5'-cyclic phosphodiesterase