General Information of the Compound
| Compound ID |
CP0529725
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| Compound Name |
2-aminobenzimidazole, 4
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| Structure |
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| Formula |
C19H12ClF3N4O
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| Molecular Weight |
404.779
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| Canonical SMILES |
FC(F)(F)c1cc(Nc2nc3ccc(Oc4ccncc4)cc3[nH]2)ccc1Cl
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| InChI |
InChI=1S/C19H12ClF3N4O/c20-15-3-1-11(9-14(15)19(21,22)23)25-18-26-16-4-2-13(10-17(16)27-18)28-12-5-7-24-8-6-12/h1-10H,(H2,25,26,27)
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| InChIKey |
NWABOGDQPNUAEX-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