General Information of the Compound
| Compound ID |
CP0572810
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| Compound Name |
6-methoxy-N,N-dimethyl-2-(4-methylpiperazin-1-yl)-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
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| Formula |
C23H36N6O2
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| Molecular Weight |
428.581
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| Canonical SMILES |
COc1cc2c(nc(nc2cc1OCCCN1CCCC1)N1CCN(C)CC1)N(C)C
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| InChI |
InChI=1S/C23H36N6O2/c1-26(2)22-18-16-20(30-4)21(31-15-7-10-28-8-5-6-9-28)17-19(18)24-23(25-22)29-13-11-27(3)12-14-29/h16-17H,5-15H2,1-4H3
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| InChIKey |
CDKBHQDWLLOMBD-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