General Information of the Compound
| Compound ID |
CP0904054
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| Compound Name |
(6-((1-(Oxetan-3-yl)-1H-indol-4-yl)oxy)pyrimidin-4-yl)methanamine
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| Structure |
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| Formula |
C16H16N4O2
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| Molecular Weight |
296.33
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| Canonical SMILES |
NCc1cc(Oc2cccc3c2ccn3C2COC2)ncn1
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| InChI |
InChI=1S/C16H16N4O2/c17-7-11-6-16(19-10-18-11)22-15-3-1-2-14-13(15)4-5-20(14)12-8-21-9-12/h1-6,10,12H,7-9,17H2
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| InChIKey |
DVFKADKNJLPHGF-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