General Information of the Compound
| Compound ID |
CP0144841
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| Compound Name |
(R)-2-(6-amino-4-oxo-1,4-dihydropyrimidin-2-ylthio)-N-(4-chlorophenyl)propanamide
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| Structure |
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| Formula |
C13H13ClN4O2S
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| Molecular Weight |
324.793
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| Canonical SMILES |
C[C@@H](Sc1nc(N)cc(=O)[nH]1)C(=O)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C13H13ClN4O2S/c1-7(21-13-17-10(15)6-11(19)18-13)12(20)16-9-4-2-8(14)3-5-9/h2-7H,1H3,(H,16,20)(H3,15,17,18,19)/t7-/m1/s1
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| InChIKey |
QIMSQHQBMNMERG-SSDOTTSWSA-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