General Information of the Compound
| Compound ID |
CP0549320
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| Compound Name |
6-chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-(2-phenylethoxy)pyrimidin-4-amine
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| Structure |
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| Formula |
C19H21ClN4OS
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| Molecular Weight |
388.924
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| Canonical SMILES |
Cc1nc(C)c(CNc2nc(OCCc3ccccc3)nc(Cl)c2C)s1
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| InChI |
InChI=1S/C19H21ClN4OS/c1-12-17(20)23-19(25-10-9-15-7-5-4-6-8-15)24-18(12)21-11-16-13(2)22-14(3)26-16/h4-8H,9-11H2,1-3H3,(H,21,23,24)
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| InChIKey |
AHPACQUBRXXUII-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