General Information of the Compound
| Compound ID |
CP0476530
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| Compound Name |
1-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]ethanol
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| Structure |
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| Formula |
C18H26N4O3S
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| Molecular Weight |
378.498
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| Canonical SMILES |
CC(O)c1cc2nc(nc(N3CCOCC3)c2s1)N1C[C@H](C)O[C@H](C)C1
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| InChI |
InChI=1S/C18H26N4O3S/c1-11-9-22(10-12(2)25-11)18-19-14-8-15(13(3)23)26-16(14)17(20-18)21-4-6-24-7-5-21/h8,11-13,23H,4-7,9-10H2,1-3H3/t11-,12+,13?
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| InChIKey |
KPYIICUHFXSFAD-FUNVUKJBSA-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