General Information of the Compound
| Compound ID |
CP0535111
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| Compound Name |
4-(Benzylamino)quinazoline deriv. 31
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| Structure |
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| Formula |
C16H15N3O
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| Molecular Weight |
265.316
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| Canonical SMILES |
COc1ccc2ncnc(NCc3ccccc3)c2c1
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| InChI |
InChI=1S/C16H15N3O/c1-20-13-7-8-15-14(9-13)16(19-11-18-15)17-10-12-5-3-2-4-6-12/h2-9,11H,10H2,1H3,(H,17,18,19)
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| InChIKey |
FNDTUROJPCNKSJ-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