General Information of the Compound
| Compound ID |
CP0567501
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| Compound Name |
6-methoxy-4-N,4-N-dimethyl-2-N-[3-(4-methylpiperazin-1-yl)propyl]-7-(3-pyrrolidin-1-ylpropoxy)quinazoline-2,4-diamine
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| Formula |
C26H43N7O2
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| Molecular Weight |
485.677
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| Canonical SMILES |
COc1cc2c(nc(NCCCN3CCN(C)CC3)nc2cc1OCCCN1CCCC1)N(C)C
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| InChI |
InChI=1S/C26H43N7O2/c1-30(2)25-21-19-23(34-4)24(35-18-8-13-32-10-5-6-11-32)20-22(21)28-26(29-25)27-9-7-12-33-16-14-31(3)15-17-33/h19-20H,5-18H2,1-4H3,(H,27,28,29)
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| InChIKey |
UEWDFXQJMZDJJE-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