General Information of the Compound
| Compound ID |
CP0054826
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| Compound Name |
(4S)-2'-morpholin-4-yl-7'-pyrimidin-5-ylspiro[5H-1,3-oxazole-4,9'-xanthene]-2-amine
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| Structure |
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| Formula |
C23H21N5O3
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| Molecular Weight |
415.453
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| Canonical SMILES |
NC1=N[C@]2(CO1)c1cc(ccc1Oc1ccc(cc21)-c1cncnc1)N1CCOCC1
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| InChI |
InChI=1S/C23H21N5O3/c24-22-27-23(13-30-22)18-9-15(16-11-25-14-26-12-16)1-3-20(18)31-21-4-2-17(10-19(21)23)28-5-7-29-8-6-28/h1-4,9-12,14H,5-8,13H2,(H2,24,27)/t23-/m0/s1
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| InChIKey |
QJHYHSYBJXSVDI-QHCPKHFHSA-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