General Information of the Compound
| Compound ID |
CP0539684
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| Compound Name |
N-[(2S)-1-[(3-fluoro-2-oxopropyl)amino]-1-oxo-3-phenylpropan-2-yl]-N-methylnaphthalene-1-carboxamide
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| Structure |
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| Formula |
C24H23FN2O3
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| Molecular Weight |
406.457
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| Canonical SMILES |
CN([C@@H](Cc1ccccc1)C(=O)NCC(=O)CF)C(=O)c1cccc2ccccc12
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| InChI |
InChI=1S/C24H23FN2O3/c1-27(24(30)21-13-7-11-18-10-5-6-12-20(18)21)22(14-17-8-3-2-4-9-17)23(29)26-16-19(28)15-25/h2-13,22H,14-16H2,1H3,(H,26,29)/t22-/m0/s1
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| InChIKey |
ZVDGRVBNUJKIMC-QFIPXVFZSA-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
Protein ID: PT03845, Cysteine protease ATG4B
Cell Viability or Cytotoxicity Assay
| Cell Line ID | Cell Line Name | Cell Line Organism | |
| CL000025 | HEK-293T | Homo sapiens (Human) | 1 |
| 1 |
CC50 > 100000 nM
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TI
LI
LO
TS
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