General Information of the Compound
| Compound ID |
CP0388485
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| Compound Name |
6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(3-methoxyphenyl)methyl]quinazolin-4-amine
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| Structure |
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| Formula |
C21H20N4O2
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| Molecular Weight |
360.417
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| Canonical SMILES |
COc1cccc(CNc2ncnc3ccc(cc23)-c2c(C)noc2C)c1
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| InChI |
InChI=1S/C21H20N4O2/c1-13-20(14(2)27-25-13)16-7-8-19-18(10-16)21(24-12-23-19)22-11-15-5-4-6-17(9-15)26-3/h4-10,12H,11H2,1-3H3,(H,22,23,24)
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| InChIKey |
LKLZFZUCOQKQKM-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