General Information of the Compound
| Compound ID |
CP0473795
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| Compound Name |
N-(cyclopropylmethyl)-2-[4-oxo-2-phenyl-6-(3-piperidin-1-ylpropoxy)quinazolin-3-yl]acetamide
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| Structure |
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| Formula |
C28H34N4O3
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| Molecular Weight |
474.605
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| Canonical SMILES |
O=C(Cn1c(nc2ccc(OCCCN3CCCCC3)cc2c1=O)-c1ccccc1)NCC1CC1
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| InChI |
InChI=1S/C28H34N4O3/c33-26(29-19-21-10-11-21)20-32-27(22-8-3-1-4-9-22)30-25-13-12-23(18-24(25)28(32)34)35-17-7-16-31-14-5-2-6-15-31/h1,3-4,8-9,12-13,18,21H,2,5-7,10-11,14-17,19-20H2,(H,29,33)
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| InChIKey |
VHWOUBBSAQAJCE-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