General Information of the Compound
| Compound ID |
CP0482212
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| Compound Name |
benzyl N-[3-[2-[(2-ethyl-5-methylpyrazole-3-carbonyl)amino]-7-methoxybenzimidazol-1-yl]propyl]carbamate
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| Structure |
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| Formula |
C26H30N6O4
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| Molecular Weight |
490.564
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| Canonical SMILES |
CCn1nc(C)cc1C(=O)Nc1nc2cccc(OC)c2n1CCCNC(=O)OCc1ccccc1
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| InChI |
InChI=1S/C26H30N6O4/c1-4-32-21(16-18(2)30-32)24(33)29-25-28-20-12-8-13-22(35-3)23(20)31(25)15-9-14-27-26(34)36-17-19-10-6-5-7-11-19/h5-8,10-13,16H,4,9,14-15,17H2,1-3H3,(H,27,34)(H,28,29,33)
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| InChIKey |
AJQFUVSSRYTHEQ-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