General Information of the Compound
| Compound ID |
CP0552455
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| Compound Name |
benzyl N-[(2S)-1-[(3-fluoro-2-oxopropyl)amino]-2-methyl-1-oxo-3-phenylpropan-2-yl]carbamate
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| Structure |
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| Formula |
C21H23FN2O4
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| Molecular Weight |
386.423
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| Canonical SMILES |
C[C@@](Cc1ccccc1)(NC(=O)OCc1ccccc1)C(=O)NCC(=O)CF
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| InChI |
InChI=1S/C21H23FN2O4/c1-21(12-16-8-4-2-5-9-16,19(26)23-14-18(25)13-22)24-20(27)28-15-17-10-6-3-7-11-17/h2-11H,12-15H2,1H3,(H,23,26)(H,24,27)/t21-/m0/s1
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| InChIKey |
RKDJXWHGULONGI-NRFANRHFSA-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