General Information of the Compound
| Compound ID |
CP0495752
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| Compound Name |
N-[(2S)-1-[(3-fluoro-2-oxopropyl)amino]-1-oxo-3-phenylpropan-2-yl]quinoline-4-carboxamide
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| Structure |
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| Formula |
C22H20FN3O3
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| Molecular Weight |
393.418
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| Canonical SMILES |
FCC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccnc2ccccc12
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| InChI |
InChI=1S/C22H20FN3O3/c23-13-16(27)14-25-22(29)20(12-15-6-2-1-3-7-15)26-21(28)18-10-11-24-19-9-5-4-8-17(18)19/h1-11,20H,12-14H2,(H,25,29)(H,26,28)/t20-/m0/s1
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| InChIKey |
FJFDUPJFYCIIJL-FQEVSTJZSA-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