General Information of the Compound
| Compound ID |
CP0377336
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| Compound Name |
(2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-(2-phenylethylamino)propanamide
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| Structure |
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| Formula |
C27H26N4O2
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| Molecular Weight |
438.531
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| Canonical SMILES |
O=C(Nc1cc(c[nH]c1=O)-c1ccncc1)[C@H](Cc1ccccc1)NCCc1ccccc1
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| InChI |
InChI=1S/C27H26N4O2/c32-26-25(18-23(19-30-26)22-12-14-28-15-13-22)31-27(33)24(17-21-9-5-2-6-10-21)29-16-11-20-7-3-1-4-8-20/h1-10,12-15,18-19,24,29H,11,16-17H2,(H,30,32)(H,31,33)/t24-/m0/s1
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| InChIKey |
DKCBDVYPDFSXEL-DEOSSOPVSA-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