General Information of the Compound
| Compound ID |
CP0567577
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| Compound Name |
tert-butyl 3-[3-[(4-bromophenyl)carbamoylamino]-2-oxopyrrolidin-1-yl]azetidine-1-carboxylate
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| Structure |
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| Formula |
C19H25BrN4O4
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| Molecular Weight |
453.337
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| Canonical SMILES |
CC(C)(C)OC(=O)N1CC(C1)N1CCC(NC(=O)Nc2ccc(Br)cc2)C1=O
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| InChI |
InChI=1S/C19H25BrN4O4/c1-19(2,3)28-18(27)23-10-14(11-23)24-9-8-15(16(24)25)22-17(26)21-13-6-4-12(20)5-7-13/h4-7,14-15H,8-11H2,1-3H3,(H2,21,22,26)
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| InChIKey |
MCUMYAKTAXMBJK-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