General Information of the Compound
| Compound ID |
CP0492930
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| Compound Name |
N-[2-[3-[2-(cyclopropylmethylamino)-2-oxoethyl]-4-oxo-2-phenylquinazolin-6-yl]oxyethyl]-3-(4-hydroxyphenyl)propanamide
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| Structure |
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| Formula |
C31H32N4O5
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| Molecular Weight |
540.62
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| Canonical SMILES |
Oc1ccc(CCC(=O)NCCOc2ccc3nc(-c4ccccc4)n(CC(=O)NCC4CC4)c(=O)c3c2)cc1
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| InChI |
InChI=1S/C31H32N4O5/c36-24-11-8-21(9-12-24)10-15-28(37)32-16-17-40-25-13-14-27-26(18-25)31(39)35(20-29(38)33-19-22-6-7-22)30(34-27)23-4-2-1-3-5-23/h1-5,8-9,11-14,18,22,36H,6-7,10,15-17,19-20H2,(H,32,37)(H,33,38)
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| InChIKey |
IKAYYYUNFUAKCG-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