General Information of the Compound
| Compound ID |
CP0476532
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| Compound Name |
[2-(2,3-dihydro-1,4-benzoxazin-4-yl)-4-morpholin-4-ylthieno[3,2-d]pyrimidin-6-yl]methanol
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| Structure |
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| Formula |
C19H20N4O3S
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| Molecular Weight |
384.461
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| Canonical SMILES |
OCc1cc2nc(nc(N3CCOCC3)c2s1)N1CCOc2ccccc12
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| InChI |
InChI=1S/C19H20N4O3S/c24-12-13-11-14-17(27-13)18(22-5-8-25-9-6-22)21-19(20-14)23-7-10-26-16-4-2-1-3-15(16)23/h1-4,11,24H,5-10,12H2
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| InChIKey |
FDJMFUPBFCVPKM-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