General Information of the Compound
| Compound ID |
CP0266597
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| Compound Name |
2-cyclopropyl-4-[4-(2-methoxyphenyl)piperidin-1-yl]-N-methyl-N-(2-morpholin-4-ylethyl)quinazolin-6-amine
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| Structure |
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| Formula |
C30H39N5O2
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| Molecular Weight |
501.675
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| Canonical SMILES |
COc1ccccc1C1CCN(CC1)c1nc(nc2ccc(cc12)N(C)CCN1CCOCC1)C1CC1
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| InChI |
InChI=1S/C30H39N5O2/c1-33(15-16-34-17-19-37-20-18-34)24-9-10-27-26(21-24)30(32-29(31-27)23-7-8-23)35-13-11-22(12-14-35)25-5-3-4-6-28(25)36-2/h3-6,9-10,21-23H,7-8,11-20H2,1-2H3
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| InChIKey |
TXOCLFUBPUBFHJ-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