General Information of the Compound
Compound ID |
CP0899518
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Compound Name |
11-(3-(dimethylamino)propylamino)-5-methyl-10H-indolo[3,2-b]quinolin-5-ium iodide
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Structure |
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Formula |
C21H25IN4
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Molecular Weight |
460.363
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Canonical SMILES |
CN(C)CCCNc1c2ccccc2[n+](C)c2c1[nH]c1ccccc12.[I-]
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InChI |
InChI=1S/C21H24N4.HI/c1-24(2)14-8-13-22-19-16-10-5-7-12-18(16)25(3)21-15-9-4-6-11-17(15)23-20(19)21;/h4-7,9-12H,8,13-14H2,1-3H3,(H,22,23);1H
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InChIKey |
YYZOYVBFICWNGM-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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