General Information of the Compound
| Compound ID |
CP0533086
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| Compound Name |
6-chloro-N-(3-chlorobenzyl)quinazolin-4-amine
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| Structure |
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| Formula |
C15H11Cl2N3
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| Molecular Weight |
304.18
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| Canonical SMILES |
Clc1cccc(CNc2ncnc3ccc(Cl)cc23)c1
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| InChI |
InChI=1S/C15H11Cl2N3/c16-11-3-1-2-10(6-11)8-18-15-13-7-12(17)4-5-14(13)19-9-20-15/h1-7,9H,8H2,(H,18,19,20)
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| InChIKey |
RJVCFPOFDWEFIH-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