General Information of the Compound
| Compound ID |
CP0127385
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| Compound Name |
4-(2-amino-1H-benzo[d]imidazol-6-ylamino)-7-(3-(dimethylamino)propoxy)-6-methylquinoline-3-carbonitrile
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| Structure |
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| Formula |
C23H25N7O
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| Molecular Weight |
415.501
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| Canonical SMILES |
CN(C)CCCOc1cc2ncc(C#N)c(Nc3ccc4nc(N)[nH]c4c3)c2cc1C
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| InChI |
InChI=1S/C23H25N7O/c1-14-9-17-19(11-21(14)31-8-4-7-30(2)3)26-13-15(12-24)22(17)27-16-5-6-18-20(10-16)29-23(25)28-18/h5-6,9-11,13H,4,7-8H2,1-3H3,(H,26,27)(H3,25,28,29)
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| InChIKey |
AKVAANQSTCMLRX-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