General Information of the Compound
| Compound ID |
CP0949883
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| Compound Name |
1-Isopropyl-3-(5-methoxy-2-pyridin-2-yl-pyrimidin-4-yl)-urea
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| Structure |
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| Formula |
C14H17N5O2
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| Molecular Weight |
287.323
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| Canonical SMILES |
COc1cnc(-c2ccccn2)nc1NC(=O)NC(C)C
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| InChI |
InChI=1S/C14H17N5O2/c1-9(2)17-14(20)19-13-11(21-3)8-16-12(18-13)10-6-4-5-7-15-10/h4-9H,1-3H3,(H2,16,17,18,19,20)
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| InChIKey |
QWDDDECELIWXSQ-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