General Information of the Compound
| Compound ID |
CP0148209
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| Compound Name |
N-[9-chloro-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]-2-(3-chlorophenyl)acetamide
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| Structure |
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| Formula |
C21H13Cl2N5O2
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| Molecular Weight |
438.274
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| Canonical SMILES |
Clc1cccc(CC(=O)Nc2nc3ccc(Cl)cc3c3nc(nn23)-c2ccco2)c1
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| InChI |
InChI=1S/C21H13Cl2N5O2/c22-13-4-1-3-12(9-13)10-18(29)25-21-24-16-7-6-14(23)11-15(16)20-26-19(27-28(20)21)17-5-2-8-30-17/h1-9,11H,10H2,(H,24,25,29)
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| InChIKey |
VWMYDUILCRHRQR-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