General Information of the Compound
| Compound ID |
CP0394342
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| Compound Name |
methyl 1-(2-acetyloxypropyl)-4-amino-2-butylimidazo[4,5-c]quinoline-7-carboxylate
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| Structure |
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| Formula |
C21H26N4O4
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| Molecular Weight |
398.463
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| Canonical SMILES |
CCCCc1nc2c(N)nc3cc(ccc3c2n1CC(C)OC(C)=O)C(=O)OC
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| InChI |
InChI=1S/C21H26N4O4/c1-5-6-7-17-24-18-19(25(17)11-12(2)29-13(3)26)15-9-8-14(21(27)28-4)10-16(15)23-20(18)22/h8-10,12H,5-7,11H2,1-4H3,(H2,22,23)
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| InChIKey |
XFEXVUXKBDTPGU-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