General Information of the Compound
| Compound ID |
CP0560436
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| Compound Name |
1-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]-2-phenylethanol
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| Structure |
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| Formula |
C24H30N4O3S
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| Molecular Weight |
454.596
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| Canonical SMILES |
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)C(O)Cc1ccccc1
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| InChI |
InChI=1S/C24H30N4O3S/c1-16-14-28(15-17(2)31-16)24-25-19-13-21(20(29)12-18-6-4-3-5-7-18)32-22(19)23(26-24)27-8-10-30-11-9-27/h3-7,13,16-17,20,29H,8-12,14-15H2,1-2H3/t16-,17+,20?
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| InChIKey |
XAYXXVZBHMBMOW-XEWABKELSA-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