General Information of the Compound
| Compound ID |
CP0680580
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| Compound Name |
(6-Chloro-quinazolin-4-yl)-(3,4,5-trimethoxy-phenyl)-amine hydrochloride
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| Structure |
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| Formula |
C17H17Cl2N3O3
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| Molecular Weight |
382.247
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| Canonical SMILES |
COc1cc(Nc2ncnc3ccc(Cl)cc23)cc(OC)c1OC.Cl
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| InChI |
InChI=1S/C17H16ClN3O3.ClH/c1-22-14-7-11(8-15(23-2)16(14)24-3)21-17-12-6-10(18)4-5-13(12)19-9-20-17;/h4-9H,1-3H3,(H,19,20,21);1H
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| InChIKey |
RVMOIKYXDCLFFJ-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