SB 590885
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SB 590885
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CAS No:
405554-55-4
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Formula:
C27H27N5O2
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Chemical Name:
SB 590885
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Synonyms:
1H-Inden-1-one,5-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-5-(4-pyridinyl)-1H-imidazol-4-yl]-2,3-dihydro-,oxime;5-[2-[4-[2-(Dimethylamino)ethoxy]phenyl]-5-(4-pyridinyl)-1H-imidazol-4-yl]-2,3-dihydro-1H-inden-1-one oxime;SB 590885;SB 590885AAE
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CAS No:
Description
SB-590885 is a potent B-Raf inhibitor with Ki of 0.16 nM, and has 11-fold greater selectivity for B-Raf over c-Raf, without inhibition to other human kinases.
(Z)-SB-590885 is an N-{5-[2-{4-[2-(dimethylamino)ethoxy]phenyl}-4-(pyridin-4-yl)-1H-imidazol-5-yl]-2,3-dihydro-1H-inden-1-ylidene}hydroxylamine in which the oxime group has Z configuration.
Characteristics
86.63000
4.87060
white to beige
1.3±0.1 g/cm3
371.8±31.5 °C
1.666
DMSO: soluble2mg/mL (clear solution, warmed)
2-8°C
Computed Properties
Molecular Weight:453.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:7
Exact Mass:453.21647512
Monoisotopic Mass:453.21647512
Topological Polar Surface Area:86.6
Heavy Atom Count:34
Complexity:674
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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