General Information of the Compound
| Compound ID |
CP0411027
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| Compound Name |
N-[(2S)-1-[[2-(2-amino-2-oxoethyl)phenyl]methylamino]-3-cyclohexyl-1-oxopropan-2-yl]-3-methyl-1,2-oxazole-5-carboxamide
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| Structure |
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| Formula |
C23H30N4O4
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| Molecular Weight |
426.517
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| Canonical SMILES |
Cc1cc(on1)C(=O)N[C@@H](CC1CCCCC1)C(=O)NCc1ccccc1CC(N)=O
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| InChI |
InChI=1S/C23H30N4O4/c1-15-11-20(31-27-15)23(30)26-19(12-16-7-3-2-4-8-16)22(29)25-14-18-10-6-5-9-17(18)13-21(24)28/h5-6,9-11,16,19H,2-4,7-8,12-14H2,1H3,(H2,24,28)(H,25,29)(H,26,30)/t19-/m0/s1
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| InChIKey |
AOSPZDVYEJMNQD-IBGZPJMESA-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