General Information of the Compound
| Compound ID |
CP0549259
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| Compound Name |
benzyl N-[(2S)-1-[(3-fluoro-2-oxopropyl)amino]-3-(3-fluorophenyl)-1-oxopropan-2-yl]carbamate
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| Structure |
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| Formula |
C20H20F2N2O4
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| Molecular Weight |
390.386
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| Canonical SMILES |
FCC(=O)CNC(=O)[C@H](Cc1cccc(F)c1)NC(=O)OCc1ccccc1
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| InChI |
InChI=1S/C20H20F2N2O4/c21-11-17(25)12-23-19(26)18(10-15-7-4-8-16(22)9-15)24-20(27)28-13-14-5-2-1-3-6-14/h1-9,18H,10-13H2,(H,23,26)(H,24,27)/t18-/m0/s1
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| InChIKey |
MSTHTKTWGVWYNM-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