SDS of cas: 37481-18-8. Aromatic compounds can be divided into two categories: single heterocycles and fused heterocycles. Compound: 2-(3,4-Dihydroquinolin-1(2H)-yl)ethanamine, is researched, Molecular C11H16N2, CAS is 37481-18-8, about Discovery of 2-[1-(4,4-Difluorocyclohexyl)piperidin-4-yl]-6-fluoro-3-oxo-2,3-dihydro-1H-isoindole-4-carboxamide (NMS-P118): A Potent, Orally Available, and Highly Selective PARP-1 Inhibitor for Cancer Therapy. Author is Papeo, Gianluca; Posteri, Helena; Borghi, Daniela; Busel, Alina A.; Caprera, Francesco; Casale, Elena; Ciomei, Marina; Cirla, Alessandra; Corti, Emiliana; D’Anello, Matteo; Fasolini, Marina; Forte, Barbara; Galvani, Arturo; Isacchi, Antonella; Khvat, Alexander; Krasavin, Mikhail Y.; Lupi, Rosita; Orsini, Paolo; Perego, Rita; Pesenti, Enrico; Pezzetta, Daniele; Rainoldi, Sonia; Riccardi-Sirtori, Federico; Scolaro, Alessandra; Sola, Francesco; Zuccotto, Fabio; Felder, Eduard R.; Donati, Daniele; Montagnoli, Alessia.
The nuclear protein poly(ADP-ribose) polymerase-1 (PARP-1) has a well-established role in the signaling and repair of DNA and is a prominent target in oncol., as testified by the number of candidates in clin. testing that unselectively target both PARP-1 and its closest isoform PARP-2. The goal of the program was to find a PARP-1 selective inhibitor that would potentially mitigate toxicities arising from cross-inhibition of PARP-2. Thus, an HTS campaign on the proprietary Nerviano Medical Sciences (NMS) chem. collection, followed by SAR optimization, allowed us to discover I. NMS-P118 proved to be a potent, orally available, and highly selective PARP-1 inhibitor endowed with excellent ADME and pharmacokinetic profiles and high efficacy in vivo both as a single agent and in combination with Temozolomide in MDA-MB-436 and Capan-1 xenograft models, resp. Cocrystal structures of I with both PARP-1 and PARP-2 catalytic domain proteins allowed rationalization of the observed selectivity.
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