General Information of the Compound
| Compound ID |
CP0305714
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| Compound Name |
6-{3-[1-(3-Dimethylamino-2,2-dimethyl-propyl)-1H-benzoimidazole-5-carbonyl]-ureido}-hexanoicacid hydroxyamide
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| Structure |
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| Formula |
C22H34N6O4
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| Molecular Weight |
446.552
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| Canonical SMILES |
CN(C)CC(C)(C)Cn1cnc2cc(ccc12)C(=O)NC(=O)NCCCCCC(=O)NO
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| InChI |
InChI=1S/C22H34N6O4/c1-22(2,13-27(3)4)14-28-15-24-17-12-16(9-10-18(17)28)20(30)25-21(31)23-11-7-5-6-8-19(29)26-32/h9-10,12,15,32H,5-8,11,13-14H2,1-4H3,(H,26,29)(H2,23,25,30,31)
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| InChIKey |
YAGVQXLSIRXWHW-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