General Information of the Compound
| Compound ID |
CP0913756
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| Compound Name |
4-tert-Butyl-6-(4-methylpiperazin-1-yl)pyrimidine
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| Structure |
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| Formula |
C13H22N4
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| Molecular Weight |
234.347
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| Canonical SMILES |
CN1CCN(c2cc(C(C)(C)C)ncn2)CC1
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| InChI |
InChI=1S/C13H22N4/c1-13(2,3)11-9-12(15-10-14-11)17-7-5-16(4)6-8-17/h9-10H,5-8H2,1-4H3
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| InChIKey |
HQNKBIZGFWKMTE-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