General Information of the Compound
| Compound ID |
CP0413885
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| Compound Name |
(2S)-N-(2-oxo-5-pyridin-4-yl-1H-pyridin-3-yl)-3-phenyl-2-[(1-pyrimidin-2-ylcyclopropyl)amino]propanamide
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| Structure |
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| Formula |
C26H24N6O2
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| Molecular Weight |
452.518
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| Canonical SMILES |
O=C(Nc1cc(c[nH]c1=O)-c1ccncc1)[C@H](Cc1ccccc1)NC1(CC1)c1ncccn1
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| InChI |
InChI=1S/C26H24N6O2/c33-23-21(16-20(17-30-23)19-7-13-27-14-8-19)31-24(34)22(15-18-5-2-1-3-6-18)32-26(9-10-26)25-28-11-4-12-29-25/h1-8,11-14,16-17,22,32H,9-10,15H2,(H,30,33)(H,31,34)/t22-/m0/s1
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| InChIKey |
WJWWGOFGWOKXSL-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