General Information of the Compound
| Compound ID |
CP0522125
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| Compound Name |
N-(cyclopropylmethyl)-2-[6-[3-(4-hydroxypiperidin-1-yl)propoxy]-4-oxo-2-phenylquinazolin-3-yl]acetamide
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| Structure |
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| Formula |
C28H34N4O4
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| Molecular Weight |
490.604
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| Canonical SMILES |
OC1CCN(CCCOc2ccc3nc(-c4ccccc4)n(CC(=O)NCC4CC4)c(=O)c3c2)CC1
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| InChI |
InChI=1S/C28H34N4O4/c33-22-11-14-31(15-12-22)13-4-16-36-23-9-10-25-24(17-23)28(35)32(19-26(34)29-18-20-7-8-20)27(30-25)21-5-2-1-3-6-21/h1-3,5-6,9-10,17,20,22,33H,4,7-8,11-16,18-19H2,(H,29,34)
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| InChIKey |
FSYKPCHOXALIGE-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