General Information of the Compound
| Compound ID |
CP0569952
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| Compound Name |
2-[(2R)-2-benzylpyrrolidin-1-yl]-4-morpholin-4-yl-1H-pyrimidin-6-one
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| Structure |
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| Formula |
C19H24N4O2
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| Molecular Weight |
340.427
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| Canonical SMILES |
Oc1cc(nc(n1)N1CCC[C@@H]1Cc1ccccc1)N1CCOCC1
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| InChI |
InChI=1S/C19H24N4O2/c24-18-14-17(22-9-11-25-12-10-22)20-19(21-18)23-8-4-7-16(23)13-15-5-2-1-3-6-15/h1-3,5-6,14,16H,4,7-13H2,(H,20,21,24)/t16-/m1/s1
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| InChIKey |
PQUHOMYHDNTHRG-MRXNPFEDSA-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