General Information of the Compound
| Compound ID |
CP0557229
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| Compound Name |
2-amino-N-[(1R)-2-amino-2-oxo-1-phenylethyl]-N-[(1R)-1-(3,5-difluorophenyl)ethyl]benzamide
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| Structure |
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| Formula |
C23H21F2N3O2
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| Molecular Weight |
409.436
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| Canonical SMILES |
C[C@@H](N([C@@H](C(N)=O)c1ccccc1)C(=O)c1ccccc1N)c1cc(F)cc(F)c1
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| InChI |
InChI=1S/C23H21F2N3O2/c1-14(16-11-17(24)13-18(25)12-16)28(23(30)19-9-5-6-10-20(19)26)21(22(27)29)15-7-3-2-4-8-15/h2-14,21H,26H2,1H3,(H2,27,29)/t14-,21-/m1/s1
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| InChIKey |
ZJVZWZAQXWIKKN-SPLOXXLWSA-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