4RB

4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-b]pyridazin-3-yl)benzoic acid

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Chemical Component Summary
Name	4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-b]pyridazin-3-yl)benzoic acid
Identifiers	4-[6-[[(2R)-1-hydroxybutan-2-yl]amino]imidazo[2,3-f]pyridazin-3-yl]benzoic acid
Formula	C₁₇ H₁₈ N₄ O₃
Molecular Weight	326.35
Type	NON-POLYMER
Isomeric SMILES	CC[C@H](CO)Nc1ccc2ncc(n2n1)c3ccc(cc3)C(=O)O
InChI	InChI=1S/C17H18N4O3/c1-2-13(10-22)19-15-7-8-16-18-9-14(21(16)20-15)11-3-5-12(6-4-11)17(23)24/h3-9,13,22H,2,10H2,1H3,(H,19,20)(H,23,24)/t13-/m1/s1
InChIKey	KKZYGUVAFJCULH-CYBMUJFWSA-N

Chemical Details
Formal Charge	0
Atom Count	42
Chiral Atom Count	1
Bond Count	44
Aromatic Bond Count	17

Drug Info: DrugBank

DrugBank ID	DB07125
Name	4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-b]pyridazin-3-yl)benzoic acid
Groups	experimental
Synonyms	4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2-b]pyridazin-3-yl)benzoic acid

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Death-associated protein kinase 3	MSTFRQEDVEDHYEMGEELGSGQFAIVRKCRQKGTGKEYAAKFIKKRRLS...	unknown

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682