General Information of the Compound
| Compound ID |
CP0823349
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| Compound Name |
(S)-N-(3-(2-amino-1,4-dimethyl-6-oxo-1,4,5,6-tetrahydropyrimidin-4-yl)phenyl)-5-chloropicolinamide
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| Structure |
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| Formula |
C18H18ClN5O2
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| Molecular Weight |
371.828
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| Canonical SMILES |
CN1C(=O)C[C@@](C)(c2cccc(NC(=O)c3ccc(Cl)cn3)c2)N=C1N
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| InChI |
InChI=1S/C18H18ClN5O2/c1-18(9-15(25)24(2)17(20)23-18)11-4-3-5-13(8-11)22-16(26)14-7-6-12(19)10-21-14/h3-8,10H,9H2,1-2H3,(H2,20,23)(H,22,26)/t18-/m0/s1
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| InChIKey |
PNANZSBGXNGJED-SFHVURJKSA-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