General Information of the Compound
| Compound ID |
CP0411031
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| Compound Name |
N-[(2S)-1-[[3-(2-amino-2-oxoethyl)phenyl]methylamino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
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| Structure |
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| Formula |
C22H28N4O4
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| Molecular Weight |
412.49
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| Canonical SMILES |
NC(=O)Cc1cccc(CNC(=O)[C@H](CC2CCCCC2)NC(=O)c2ccno2)c1
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| InChI |
InChI=1S/C22H28N4O4/c23-20(27)13-16-7-4-8-17(11-16)14-24-21(28)18(12-15-5-2-1-3-6-15)26-22(29)19-9-10-25-30-19/h4,7-11,15,18H,1-3,5-6,12-14H2,(H2,23,27)(H,24,28)(H,26,29)/t18-/m0/s1
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| InChIKey |
SKDZOMABTMURSP-SFHVURJKSA-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