General Information of the Compound
| Compound ID |
CP0795560
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| Compound Name |
5-chloro-6-(2-(hydroxymethyl)piperidin-1-yl)pyrimidine-2,4(1H,3H)-dione hydrochloride
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| Structure |
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| Formula |
C10H15Cl2N3O3
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| Molecular Weight |
296.154
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| Canonical SMILES |
Cl.OCC1CCCCN1c1nc(O)nc(O)c1Cl
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| InChI |
InChI=1S/C10H14ClN3O3.ClH/c11-7-8(12-10(17)13-9(7)16)14-4-2-1-3-6(14)5-15;/h6,15H,1-5H2,(H2,12,13,16,17);1H
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| InChIKey |
KNRYPVUQSFQXTE-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