General Information of the Compound
| Compound ID |
CP0380566
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| Compound Name |
4-[6-Methoxy-7-(2-morpholin-4-yl-ethoxy)-quinazolin-4-yl]-piperazine-1-carboxylic acid (4-isopropoxy-phenyl)-amide
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| Structure |
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| Formula |
C29H38N6O5
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| Molecular Weight |
550.66
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| Canonical SMILES |
COc1cc2c(ncnc2cc1OCCN1CCOCC1)N1CCN(CC1)C(=O)Nc1ccc(OC(C)C)cc1
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| InChI |
InChI=1S/C29H38N6O5/c1-21(2)40-23-6-4-22(5-7-23)32-29(36)35-10-8-34(9-11-35)28-24-18-26(37-3)27(19-25(24)30-20-31-28)39-17-14-33-12-15-38-16-13-33/h4-7,18-21H,8-17H2,1-3H3,(H,32,36)
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| InChIKey |
KBLUSSDJBNCULP-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