General Information of the Compound
| Compound ID |
CP0541494
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| Compound Name |
5-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]pyridin-2-amine
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| Structure |
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| Formula |
C21H26N6O2S
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| Molecular Weight |
426.546
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| Canonical SMILES |
C[C@H]1CN(C[C@@H](C)O1)c1nc(N2CCOCC2)c2sc(cc2n1)-c1ccc(N)nc1
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| InChI |
InChI=1S/C21H26N6O2S/c1-13-11-27(12-14(2)29-13)21-24-16-9-17(15-3-4-18(22)23-10-15)30-19(16)20(25-21)26-5-7-28-8-6-26/h3-4,9-10,13-14H,5-8,11-12H2,1-2H3,(H2,22,23)/t13-,14+
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| InChIKey |
VWAPFXOEOXOOSM-OKILXGFUSA-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