General Information of the Compound
| Compound ID |
CP0531055
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| Compound Name |
2-cyclohexyl-6-methoxy-7-piperidin-4-yl-N-(1-propan-2-ylpiperidin-4-yl)quinazolin-4-amine
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| Structure |
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| Formula |
C28H43N5O
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| Molecular Weight |
465.686
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| Canonical SMILES |
COc1cc2c(NC3CCN(CC3)C(C)C)nc(nc2cc1C1CCNCC1)C1CCCCC1
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| InChI |
InChI=1S/C28H43N5O/c1-19(2)33-15-11-22(12-16-33)30-28-24-18-26(34-3)23(20-9-13-29-14-10-20)17-25(24)31-27(32-28)21-7-5-4-6-8-21/h17-22,29H,4-16H2,1-3H3,(H,30,31,32)
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| InChIKey |
ZZBKSAODRXUWMW-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