General Information of the Compound
| Compound ID |
CP0284964
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| Compound Name |
1-[2-(1H-imidazol-1-yl)-4-pyrimidinyl]-N-[(2-pyridinyl)methyl]-2-piperidineacetamide
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| Structure |
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| Formula |
C20H23N7O
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| Molecular Weight |
377.452
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| Canonical SMILES |
O=C(CC1CCCCN1c1ccnc(n1)-n1ccnc1)NCc1ccccn1
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| InChI |
InChI=1S/C20H23N7O/c28-19(24-14-16-5-1-3-8-22-16)13-17-6-2-4-11-27(17)18-7-9-23-20(25-18)26-12-10-21-15-26/h1,3,5,7-10,12,15,17H,2,4,6,11,13-14H2,(H,24,28)
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| InChIKey |
NOQHBAPFLBFZJH-UHFFFAOYSA-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