General Information of the Compound
| Compound ID |
CP0504498
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| Compound Name |
2-(2-(3-methoxyphenyl)-6-(3-morpholinopropoxy)-4-oxoquinazolin-3(4H)-yl)-N-propylacetamide
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| Structure |
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| Formula |
C27H34N4O5
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| Molecular Weight |
494.592
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| Canonical SMILES |
CCCNC(=O)Cn1c(nc2ccc(OCCCN3CCOCC3)cc2c1=O)-c1cccc(OC)c1
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| InChI |
InChI=1S/C27H34N4O5/c1-3-10-28-25(32)19-31-26(20-6-4-7-21(17-20)34-2)29-24-9-8-22(18-23(24)27(31)33)36-14-5-11-30-12-15-35-16-13-30/h4,6-9,17-18H,3,5,10-16,19H2,1-2H3,(H,28,32)
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| InChIKey |
IWDDSZCVBMICFY-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