C44h53fn7o8 Guanoosin, 5 '-o- [4-Methodylyl) Phenylthyl] -2' - Fluoroxyl-2 '- Fluchoanl (1-Methyl Bild vun Image

C44H53FN7OCE7_OOSE, 5 '-o- [4-Methodyphyl) Phenylthyl] -2' - Flumooryl-2 '- Flumooryl-2' - Fluchoanh5h53L53L_Thyl) Phosphoramidite] (ACI)

Basis Informatioun:

Schéckt E-Mail un eis

Promrat Detail

Produktiounsnagéieren

Stoff Detail

Fas Registry Nummer

144089-97-4

Schlëssel kierperlech Eegeschafte	Wäert	Bedingchmëttel
Molekular Gewiicht	857.91	-
pka (virausgesot)	9.16 ± 0,20	Meescht sauer Tempo: 25 ° C

Aner Nimm an Identifizéierer

Canonesch Laachen

N # CCCOP (OC1C (F) C (O) C = 2C = CC = CC25) N (C (c) c) c (c3 = CC = CC = CC = NCL = 6c = O) n = CCPOP (NC (O) C (C) C) NC25) N (C (C) C) C = CC = CC = CC = CC = CC = 6C = O) N = CCPOP (NC (O) c (C) C) NC65) N (c (c) c) c

Isomeresch Laachen

C (c2) c (= O) n = c (nc (c (c (c) c) c (c) n) (c4 = cc = cc = C2 (O1 = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6

Inchi

InChI= 1S/C44H53FN7O8P/c1-27(2)40(53)49-43-48-39-37(41(54)50-43)47-26-51(39)42-36(45)38(60-61(58-24-12-23-46)52(28(3)4)29(5) 6) 35 (59-42) 25-57-44 (30-13-116-29,30.31-19-338,42h, 12-17-17-31) 36-31) 36-31) 36-31) 36-31) 36-31) 36-31) 36-31) 24-25h2.1-8 Auer, (h & --28.48.5000)) / t35-, 38-, 38-, 48-

Inchi Schlëssel

Kjfumxzvymqeu-aocjbpqjsa-n

1 aneren Numm fir dës Substanz

Guanosin, 5 '-O- [BI (4-Methoxyphonyl) Phenylthyl] -2 '-deoxy-2' -fluoro-N- (2-Methyl-1-oxopropyl) -, 3 '- [2-cyanethyl Bis (1-methyl) Phosphoder)

Virausgesot Eegeschafte

Eegeschafte verfügbar
Biologesch
Chemeschen
Lipinski
Struktur verbonnen

Biologesch

Prowalange	Wäert	Bedingchmëttel	Quellatioun
BIKOCONSENTRATIOUN FIELD	298	pH 1; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	6350	pH 2; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	578800	pH 3; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	1.76 X 105	pH 4; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	2.21 x 105	pH 5; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	2.26 x 105	pH 6; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	2.24 X 105	pH 7; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	2.03 x 105	pH 8; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	1.04 x 105	pH 9; Temp: 25 ° C	(1) ACD
BIKOCONSENTRATIOUN FIELD	19300	ph 10; Temp: 25 ° C	(1) ACD

Chemeschen

Eegeschafte Wäert Zoustand

Kok 312 PH 1; Temp: 25 ° C (1) ACD

Koc 6630 ph 2; Temp: 25 ° C (1) ACD

Koc 60400 PH 3; Temp: 25 ° C (1) ACD

Koc 1,84 x 105 PH 4; Temp: 25 ° C (1) ACD

Koc 2.31 x 105 PH 5; Temp: 25 ° C (1) ACD

Koc 2.37 x 105 PH 6; Temp: 25 ° C (1) ACD

Koc 2.35 x 105 PH 7; Temp: 25 ° C (1) ACD

Koc 2.12 x 105 PH 8; Temp: 25 ° C (1) ACD

Koc 1.08 x 105 PH 9; Temp: 25 ° C (1) ACD

Koc 20200 PH 10; Temp: 25 ° C (1) ACD

logd 4.47 pH 1; Temp: 25 ° C (1) ACD

logd 580 pH 2; Temp: 25 ° C (1) ACD

Prowalange	Wäert	Bedingchmëttel	Quellatioun
Aloggenlogt	6.76	pH 3; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.244	pH 4; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.34	pH 5; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.35	pH 6; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.35	pH 7; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.30 Auer	pH 8; Temp: 25 ° C	(1) ACD
Aloggenlogt	7.01	pH 9; Temp: 25 ° C	(1) ACD
Aloggenlogt	6,28	ph 10; Temp: 25 ° C	(1) ACD
AloggenO Aloggen	7.351 ± 0,713	Temp: 25 ° C	(1) ACD
Mass intrinsesch Solubilitéit	3.0 x 10-5 g / l	Temp: 25 ° C	(1) ACD
Massebelibilitéit	0,022 g / l	pH 1; Temp: 25 ° C	(1) ACD
Massebelibilitéit	1.0 x 10-3 g / l	pH 2; Temp: 25 ° C	(1) ACD
Massebelibilitéit	1.2 x 10-4 g / l	pH 3; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.9 x 10-5 g / l	pH 4; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.1 x 10-5 g / l	pH 5; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.0 x 10-5 g / l	pH 6; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.0 x 10-5 g / l	pH 7; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.3 x 10-5 g / l	pH 8; Temp: 25 ° C	(1) ACD
Massebelibilitéit	6.5 x 10-5 g / l	pH 9; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.5 x 10-4 g / l	ph 10; Temp: 25 ° C	(1) ACD
Massebelibilitéit	3.0 x 10-5 g / l	Ongebrach Waasser ph 7.00; Temp: 25 ° C	(1) ACD
Molar intrinsesch Solubilitéit	3.5 x 10-8 MOL / L	Temp: 25 ° C	(1) ACD
Molar sublabilitéit	2.6 x 10-5 MOL / L	pH 1; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	1.2 X 10-6 MOL / L	pH 2; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	1.4 x 10-7 Mol / l	pH 3; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	4,5 x 10-8 MOL / L	pH 4; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	3.6 x 10-8 MOL / L	pH 5; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	3.5 x 10-8 MOL / L	pH 6; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	3.5 x 10-8 MOL / L	pH 7; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	3.9 X 10-8 MOL / L	pH 8; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	7.6 x 10-8 MOL / L	pH 9; Temp: 25 ° C	(1) ACD
Molar sublabilitéit	4.1 x 10-7 MOL / L	ph 10; Temp: 25 ° C	(1) ACD

Prowalange	Wäert	Bedingchmëttel	Quellatioun
Molar sublabilitéit	3.5 x 10-8 MOL / L	Ongebrach Waasser ph 7.00; Temp: 25 ° C	(1) ACD
Molekular Gewiicht	857.91
paka	9.16 ± 0,20	Meescht sauer Tempo: 25 ° C	(1) ACD
paka	3.45 ± 0.70	Déi meescht Basis Tempo: 25 ° C	(1) ACD

Struktur verbonnen

Prowalange	Wäert	Konditiounsquell
Polarfläch	184 A2	(1) ACD

Lipinski

Prowalange	Wäert	Bedingchmëttel	Quellatioun
Fräi rotativ Obligatiounen	18		(1) ACD
H Akzeptoren	15		(1) ACD
H Donateuren	2		(1) ACD
H Spender / Acceptor Zomm	17		(1) ACD
AloggenO Aloggen	7.351 ± 0,713	Temp: 25 ° C	(1) ACD
Molekular Gewiicht	857.91