General Information of the Compound
| Compound ID |
CP0501056
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| Compound Name |
6-(4-chlorophenyl)-3-[(4-isopropylmorpholin-2-yl)methyl]-2-(2-methylphenyl)quinazolin-4(3H)-one
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| Structure |
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| Formula |
C29H30ClN3O2
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| Molecular Weight |
488.031
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| Canonical SMILES |
CC(C)N1CCOC(Cn2c(nc3ccc(cc3c2=O)-c2ccc(Cl)cc2)-c2ccccc2C)C1
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| InChI |
InChI=1S/C29H30ClN3O2/c1-19(2)32-14-15-35-24(17-32)18-33-28(25-7-5-4-6-20(25)3)31-27-13-10-22(16-26(27)29(33)34)21-8-11-23(30)12-9-21/h4-13,16,19,24H,14-15,17-18H2,1-3H3
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| InChIKey |
AWXHNHYIKOYDPD-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