General Information of the Compound
| Compound ID |
CP0806766
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| Compound Name |
5-chloro-6-(3-(2-hydroxyethyl)piperidin-1-yl)pyrimidine-2,4(1H,3H)-dione hydrochloride
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| Structure |
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| Formula |
C11H17Cl2N3O3
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| Molecular Weight |
310.181
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| Canonical SMILES |
Cl.OCCC1CCN(c2nc(O)nc(O)c2Cl)CC1
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| InChI |
InChI=1S/C11H16ClN3O3.ClH/c12-8-9(13-11(18)14-10(8)17)15-4-1-7(2-5-15)3-6-16;/h7,16H,1-6H2,(H2,13,14,17,18);1H
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| InChIKey |
CRQFGYQFQOYTFD-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