C33H35N3O8 Cytidine, N-acetyl-5′-O-

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Ibicuruzwa birambuye

Ibicuruzwa

Imiterere yumubiri

Ibyingenzi Byumubiri	Agaciro	Imiterere
Uburemere bwa molekile	601.65	-
Ubucucike (Biteganijwe)	1.28 ± 0.1 g / cm3	Ubushyuhe: 20 ° C; Kanda: 760 Torr
pKa (Byahanuwe)	10.19 ± 0.20	Ubushyuhe bwinshi bwa Acide: 25 ° C.

Andi mazina nibiranga

Urwenya rwa Canonical O = C1N = C (C = CN1C2OC (COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) C (O ) C2OC) NC (= O) C.
SMILES Isomeric C (OC [C @ H] 1O [C @ H] ([C @ H] (OC) [C @@ H] 1O) N2C (= O) N = C (NC (C) = O) C = C2) (C3 = CC = C (OC) C = C3) (C4 = CC = C (OC) C = C4) C5 = CC = CC = C5
InChI
InChI = 1S / C33H35N3O8 / c1-21 (37) 34-28-18-19-36 (32 (39) 35-28) 31-30 (42-4) 29 (38) 27 (44-31) 20- 43-33 (22-8-6-5-7-9-22,23-10-14-25 (40-2) 15-11-23) 24-12-16-26 (41-3) 17- 13-24 / h5-19,27,29-31,38H, 20H2,1-4H3, (H, 34,35,37,39) / t27-, 29-, 30-, 31- / m1 / s1
InChI Urufunguzo
FINUHOJILDNELQ-PMFUCWTESA-N
1 Irindi zina kuriyi ngingo
N-Acetyl-5′-O-

Ibintu Byateganijwe

Ibyiza birahari

Ibinyabuzima

Imiti

Ubucucike

Lipinski

Imiterere ijyanye

Ibinyabuzima

Umutungo	Agaciro	Imiterere	Inkomoko
Ikintu cya Bioconcentration	8.87	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	27.8	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	171	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	515	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	650	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	668	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	668	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	657	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	560	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Ikintu cya Bioconcentration	229	pH 10; Ubushyuhe: 25 ° C.	(1) ACD

Imiti

Umutungo	Agaciro	Imiterere	Inkomoko
Koc	48.6	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Koc	152	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Koc	935	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Koc	2820	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Koc	3560	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Koc	3660	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Koc	3660	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Koc	3600	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Koc	3070	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Koc	1250	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
logD	2.14	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
logD	2.64	pH 2; Ubushyuhe: 25 ° C.	(1) ACD

Umutungo	Agaciro	Imiterere	Inkomoko
logD	3.43	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
logD	3.91	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.01	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.02	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.02	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
logD	4.01	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
logD	3.94	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
logD	3.55	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
logP	4.021 ± 0.768	Ubushyuhe: 25 ° C.	(1) ACD
Mass Massins Solubility	1.3 x 10-3 g / L.	Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	0,10 g / L.	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	0.032 g / L.	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	5.2 x 10-3 g / L.	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.7 x 10-3 g / L.	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.4 x 10-3 g / L.	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.3 x 10-3 g / L.	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.3 x 10-3 g / L.	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.3 x 10-3 g / L.	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.6 x 10-3 g / L.	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	3.9 x 10-3 g / L.	pH 10; Ubushyuhe: 25 ° C.	(1) ACD
Gukemura ibibazo	1.3 x 10-3 g / L.	Amazi adafite amazi pH 6.99; Ubushyuhe: 25 ° C.	(1) ACD
Molar Intrinsic Solubility	2.2 x 10-6 mol / L.	Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	1.7 x 10-4 mol / L.	pH 1; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	5.3 x 10-5 mol / L.	pH 2; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	8.6 x 10-6 mol / L.	pH 3; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.9 x 10-6 mol / L.	pH 4; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.3 x 10-6 mol / L.	pH 5; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.2 x 10-6 mol / L.	pH 6; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.2 x 10-6 mol / L.	pH 7; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.2 x 10-6 mol / L.	pH 8; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	2.6 x 10-6 mol / L.	pH 9; Ubushyuhe: 25 ° C.	(1) ACD
Amashanyarazi	6.4 x 10-6 mol / L.	pH 10; Ubushyuhe: 25 ° C.	(1) ACD

Umutungo	Agaciro	Imiterere	Inkomoko
Amashanyarazi	2.2 x 10-6 mol / L.	Amazi adafite amazi pH 6.99; Ubushyuhe: 25 ° C.	(1) ACD
Uburemere bwa molekile	601.65
pKa	10.19 ± 0.20	Ubushyuhe bwinshi bwa Acide: 25 ° C.	(1) ACD
pKa	3.57 ± 0.20	Ubushyuhe bwibanze: 25 ° C.	(1) ACD

Ubucucike

Umutungo	Agaciro	Imiterere	Inkomoko
Ubucucike	1.28 ± 0.1 g / cm3	Ubushyuhe: 20 ° C; Kanda: 760 Torr	(1) ACD
Umubumbe wa Molar	466.5 ± 7.0 cm3 / mol	Ubushyuhe: 20 ° C; Kanda: 760 Torr	(1) ACD

Lipinski

Umutungo	Agaciro	Imiterere	Inkomoko
Impapuro zishobora guhinduka	11		(1) ACD
H Abakira	11		(1) ACD
H Abaterankunga	2		(1) ACD
H Abaterankunga / Abemera Sum	13		(1) ACD
logP	4.021 ± 0.768	Ubushyuhe: 25 ° C.	(1) ACD
Uburemere bwa molekile	601.65