General Information of the Compound
| Compound ID |
CP0384410
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| Compound Name |
6-(Benzylylamino)-1-isopropyl-4-(4-isopropyl-phenyl)-1H-quinazolin-2-one
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| Structure |
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| Formula |
C27H29N3O
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| Molecular Weight |
411.549
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| Canonical SMILES |
CC(C)c1ccc(cc1)-c1nc(=O)n(C(C)C)c2ccc(NCc3ccccc3)cc12
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| InChI |
InChI=1S/C27H29N3O/c1-18(2)21-10-12-22(13-11-21)26-24-16-23(28-17-20-8-6-5-7-9-20)14-15-25(24)30(19(3)4)27(31)29-26/h5-16,18-19,28H,17H2,1-4H3
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| InChIKey |
GPVDDWUSJONEJY-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