General Information of the Compound
| Compound ID |
CP0132452
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| Compound Name |
1-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]-N-(phenylmethyl)-2-piperidineacetamide
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| Structure |
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| Formula |
C21H24N6O
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| Molecular Weight |
376.464
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| Canonical SMILES |
O=C(CC1CCCCN1c1ccnc(n1)-n1ccnc1)NCc1ccccc1
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| InChI |
InChI=1S/C21H24N6O/c28-20(24-15-17-6-2-1-3-7-17)14-18-8-4-5-12-27(18)19-9-10-23-21(25-19)26-13-11-22-16-26/h1-3,6-7,9-11,13,16,18H,4-5,8,12,14-15H2,(H,24,28)
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| InChIKey |
YDZKZOIFEBHVTR-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