General Information of the Compound
| Compound ID |
CP0504993
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| Compound Name |
6-(4-bromophenylamino)-1-isopropyl-4,4-dimethyl-1H-benzo[d][1,3]oxazin-2(4H)-one
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| Structure |
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| Formula |
C19H21BrN2O2
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| Molecular Weight |
389.293
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| Canonical SMILES |
CC(C)N1C(=O)OC(C)(C)c2cc(Nc3ccc(Br)cc3)ccc12
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| InChI |
InChI=1S/C19H21BrN2O2/c1-12(2)22-17-10-9-15(21-14-7-5-13(20)6-8-14)11-16(17)19(3,4)24-18(22)23/h5-12,21H,1-4H3
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| InChIKey |
KDFQMXOKQLFCLM-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