General Information of the Compound
| Compound ID |
CP0504044
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| Compound Name |
3-(((4-Amino-1-(2-hydroxy-2-methylpropyl)-1H-imidazo[4,5-c]quinolin-2-yl)methyl)(ethyl)amino)-propanenitrile
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| Structure |
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| Formula |
C20H26N6O
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| Molecular Weight |
366.469
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| Canonical SMILES |
CCN(CCC#N)Cc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O
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| InChI |
InChI=1S/C20H26N6O/c1-4-25(11-7-10-21)12-16-24-17-18(26(16)13-20(2,3)27)14-8-5-6-9-15(14)23-19(17)22/h5-6,8-9,27H,4,7,11-13H2,1-3H3,(H2,22,23)
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| InChIKey |
QKLTXSODHYZTGK-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