General Information of the Compound
| Compound ID |
CP0420420
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| Compound Name |
[3-[(2-pyridin-3-ylquinazolin-4-yl)amino]phenyl]methanol
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| Structure |
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| Formula |
C20H16N4O
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| Molecular Weight |
328.375
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| Canonical SMILES |
OCc1cccc(Nc2nc(nc3ccccc23)-c2cccnc2)c1
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| InChI |
InChI=1S/C20H16N4O/c25-13-14-5-3-7-16(11-14)22-20-17-8-1-2-9-18(17)23-19(24-20)15-6-4-10-21-12-15/h1-12,25H,13H2,(H,22,23,24)
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| InChIKey |
BTAOEXDWHQLZHX-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