General Information of the Compound
| Compound ID |
CP0121027
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| Compound Name |
N-(5-tert-butyl-1,2-oxazol-3-yl)-2-(3-imidazo[1,2-b]pyridazin-6-yloxyphenyl)acetamide
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| Structure |
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| Formula |
C21H21N5O3
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| Molecular Weight |
391.431
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| Canonical SMILES |
CC(C)(C)c1cc(NC(=O)Cc2cccc(Oc3ccc4nccn4n3)c2)no1
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| InChI |
InChI=1S/C21H21N5O3/c1-21(2,3)16-13-17(25-29-16)23-19(27)12-14-5-4-6-15(11-14)28-20-8-7-18-22-9-10-26(18)24-20/h4-11,13H,12H2,1-3H3,(H,23,25,27)
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| InChIKey |
VRNLJQHAJGRGJN-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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