General Information of the Compound
| Compound ID |
CP0488631
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| Compound Name |
(2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-(pyridin-2-ylmethylamino)propanamide
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| Structure |
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| Formula |
C25H23N5O2
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| Molecular Weight |
425.492
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| Canonical SMILES |
O=C(Nc1cc(c[nH]c1=O)-c1ccncc1)[C@H](Cc1ccccc1)NCc1ccccn1
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| InChI |
InChI=1S/C25H23N5O2/c31-24-23(15-20(16-29-24)19-9-12-26-13-10-19)30-25(32)22(14-18-6-2-1-3-7-18)28-17-21-8-4-5-11-27-21/h1-13,15-16,22,28H,14,17H2,(H,29,31)(H,30,32)/t22-/m0/s1
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| InChIKey |
KSSZQVWXWHOPPO-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