General Information of the Compound
| Compound ID |
CP0322285
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| Compound Name |
N-(3H-benzimidazol-5-yl)-6,7-dimethoxyquinazolin-4-amine
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| Structure |
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| Formula |
C17H15N5O2
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| Molecular Weight |
321.34
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| Canonical SMILES |
COc1cc2ncnc(Nc3ccc4[nH]cnc4c3)c2cc1OC
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| InChI |
InChI=1S/C17H15N5O2/c1-23-15-6-11-13(7-16(15)24-2)19-9-21-17(11)22-10-3-4-12-14(5-10)20-8-18-12/h3-9H,1-2H3,(H,18,20)(H,19,21,22)
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| InChIKey |
UVCICGUVSJJFGD-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