General Information of the Compound
| Compound ID |
CP0547731
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| Compound Name |
(2s,4S)-N-((1s,3S)-3-(3-Cyclopropyl-5-methylphenyl)cyclobutyl)-N-methyl-6-oxo-
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| Formula |
C22H28N2O3
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| Molecular Weight |
368.477
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| Canonical SMILES |
CN([C@H]1C[C@H](C1)c1cc(C)cc(c1)C1CC1)C(=O)[C@H]1C[C@@]2(C1)COC(=O)N2
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| InChI |
InChI=1S/C22H28N2O3/c1-13-5-15(14-3-4-14)7-16(6-13)17-8-19(9-17)24(2)20(25)18-10-22(11-18)12-27-21(26)23-22/h5-7,14,17-19H,3-4,8-12H2,1-2H3,(H,23,26)/t17-,18-,19+,22+
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| InChIKey |
DGKVXTAHMNCGJL-ZNEYZUKJSA-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