General Information of the Compound
| Compound ID |
CP0514459
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| Compound Name |
2-aminobenzimidazole-based compound, 22
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| Structure |
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| Formula |
C23H22FN5O
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| Molecular Weight |
403.461
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| Canonical SMILES |
CC(C)N(C)c1nc2ccc(NC(=O)c3ccc(nc3)-c3ccc(F)cc3)cc2[nH]1
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| InChI |
InChI=1S/C23H22FN5O/c1-14(2)29(3)23-27-20-11-9-18(12-21(20)28-23)26-22(30)16-6-10-19(25-13-16)15-4-7-17(24)8-5-15/h4-14H,1-3H3,(H,26,30)(H,27,28)
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| InChIKey |
WHHWLYLHRWBOHZ-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