General Information of the Compound
| Compound ID |
CP0036755
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| Compound Name |
Benzyl-(9-chloro-2-furan-2-yl-[1,2,4]triazolo[1,5-c]quinazolin-5-yl)-amine
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| Structure |
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| Formula |
C20H14ClN5O
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| Molecular Weight |
375.819
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| Canonical SMILES |
Clc1ccc2nc(NCc3ccccc3)n3nc(nc3c2c1)-c1ccco1
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| InChI |
InChI=1S/C20H14ClN5O/c21-14-8-9-16-15(11-14)19-24-18(17-7-4-10-27-17)25-26(19)20(23-16)22-12-13-5-2-1-3-6-13/h1-11H,12H2,(H,22,23)
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| InChIKey |
LREUJMKERSIZBI-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