General Information of the Compound
| Compound ID |
CP0536577
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| Compound Name |
(2S)-2-amino-3-(4-methylphenyl)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)propanamide
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| Structure |
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| Formula |
C20H20N4O2
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| Molecular Weight |
348.406
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| Canonical SMILES |
Cc1ccc(C[C@H](N)C(=O)Nc2cc(c[nH]c2=O)-c2ccncc2)cc1
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| InChI |
InChI=1S/C20H20N4O2/c1-13-2-4-14(5-3-13)10-17(21)19(25)24-18-11-16(12-23-20(18)26)15-6-8-22-9-7-15/h2-9,11-12,17H,10,21H2,1H3,(H,23,26)(H,24,25)/t17-/m0/s1
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| InChIKey |
NTZHGDLSLGWDGT-KRWDZBQOSA-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