C15H21N5O6 Guanosine, 2'-O-Methyl-N- (2-methyl-1-OxOproPyl) - (9ci, Aci)
Fananana ara-batana lehibe | sarobidy | toe-javatra |
Lanjan'ny molekiola | 367.36 | - |
Fahalemena (nambara) | 1.68 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr |
PKA (nambara) | 9.16 ± 0.20 | Ankamaroan'ny temps temp: 25 ° C |
Kanonika Smiles O = C1N = C (NC (= O) C (C) C (C) C) NC2 = CN2C3OC (CO) C (CO) C (CO) C (CO) C (O) C (O) C (O) C3OC
Isomeric Smiles o (c) [c @ h] 1 [C @ h] (N2C3 = C (N = C2) C (= O) N = C (NC (C (NC (C (C (C (C (C (C (C (C (C (C (C (C (C (C (C (C (C
Inchi
Inchi = 1s / c15h21n5o6 / c1-6 (2) 12 (23) 18-15-17-11-8 (13 (24) 19-15) 16-5-20 (11-15 (25-3) 9 (22) 7 (4-21) 26-14 / H5-7,9-14 / H5-7,9-14 / H5-7,9-14 / H5-7,9-14 / H5-7,9 22h, 4h2,1-3h3, (H2217.2373,19,19,23) / t7-, 9-, 14- / / m1 / s1
Inchi Key
Rpulcyxeodyqog-akaijsegsa-n
2 anarana hafa ho an'ity akora ity
2'-O-Methyl-N- (2-methyl-1-oxoopropyl) guanosine (Aci);N2-isobutyryl-2'-O-methylguanosine
Spectra misy
1H NMR
13c NMR
-bahoaka
Fananana misy |
niteraka |
simika |
hakitroky |
Lipinski |
Mifandraika mifandraika |
niteraka
NY FANANANA | sarobidy | toe-javatra | Source |
Factor Bioconcentration | 1.0 | PH 1; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 2; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 3; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 4; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 5; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 6; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 7; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 8; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 9; Temp: 25 ° C | (1) ACD |
Factor Bioconcentration | 1.0 | PH 10; Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
simika
NY FANANANA | sarobidy | toe-javatra | Source |
Koc | 2.12 | PH 1; Temp: 25 ° C | (1) ACD |
Koc | 8.67 | PH 2; Temp: 25 ° C | (1) ACD |
Koc | 12.6 | PH 3; Temp: 25 ° C | (1) ACD |
Koc | 13.3 | PH 4; Temp: 25 ° C | (1) ACD |
Koc | 13.3 | PH 5; Temp: 25 ° C | (1) ACD |
Koc | 13.3 | PH 6; Temp: 25 ° C | (1) ACD |
Koc | 13.2 | PH 7; Temp: 25 ° C | (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
Koc | 12.5 | PH 8; Temp: 25 ° C | (1) ACD |
Koc | 7.85 | PH 9; Temp: 25 ° C | (1) ACD |
Koc | 1.76 | PH 10; Temp: 25 ° C | (1) ACD |
LogD | -1.26 | PH 1; Temp: 25 ° C | (1) ACD |
LogD | -0.65 | PH 2; Temp: 25 ° C | (1) ACD |
LogD | -0.49 | PH 3; Temp: 25 ° C | (1) ACD |
LogD | -0.47 | PH 4; Temp: 25 ° C | (1) ACD |
LogD | -0.46 | PH 5; Temp: 25 ° C | (1) ACD |
LogD | -0.46 | PH 6; Temp: 25 ° C | (1) ACD |
LogD | -0.47 | PH 7; Temp: 25 ° C | (1) ACD |
LogD | -0.49 | PH 8; Temp: 25 ° C | (1) ACD |
LogD | -0.69 | PH 9; Temp: 25 ° C | (1) ACD |
LogD | -1.34 | PH 10; Temp: 25 ° C | (1) ACD |
Logp | -0.464 ± 0.636 | Temp: 25 ° C | (1) ACD |
Solondrailala an-tsokosoko | 0.55 g / l | Temp: 25 ° C | (1) ACD |
Supubility Mass | 3.5 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.84 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.59 g / l | PH 3; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.55 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.55 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.55 g / l | PH 6; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.55 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.59 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.96 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Supubility Mass | 4.4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Supubility Mass | 0.55 g / l | Rano tsy voaroy 6,00; Temp: 25 ° C | (1) ACD |
Movra intrinsic solubility | 1.5 x 10-3 Mol / l | Temp: 25 ° C | (1) ACD |
Molar Solubility | 9.6 x 10-3 Mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.3 x 10-3 Mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.6 x 10-3 Mol / l | PH 3; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.5 x 10-3 Mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.5 x 10-3 Mol / l | PH 5; Temp: 25 ° C | (1) ACD |
NY FANANANA | sarobidy | toe-javatra | Source |
Molar Solubility | 1.5 x 10-3 Mol / l | PH 6; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.5 x 10-3 Mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.6 x 10-3 Mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Molar Solubility | 2.6 x 10-3 Mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Molar Solubility | 0.012 Mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Molar Solubility | 1.5 x 10-3 Mol / l | Rano tsy voaroy 6,00; Temp: 25 ° C | (1) ACD |
Lanjan'ny molekiola | 367.36 | ||
pka | 9.16 ± 0.20 | Ankamaroan'ny temps temp: 25 ° C | (1) ACD |
pka | 1.73 ± 0.10 | Ny ankamaroan'ny Temp: 25 ° C | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
hakitroky
NY FANANANA | sarobidy | toe-javatra | Source |
hakitroky | 1.68 ± 0.1 g / cm3 | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
Molar volume | 217.6 ± 7.0 cm3 / mol | Temp: 20 ° C; Press: 760 Torr | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Lipinski
NY FANANANA | sarobidy | toe-javatra | Source |
Fatorana rotatateble malalaka | 6 | (1) ACD | |
H Mpanaja | 11 | (1) ACD | |
H mpamatsy vola | 4 | (1) ACD | |
H Donor / Accas Sum | 15 | (1) ACD | |
Logp | -0.464 ± 0.636 | Temp: 25 ° C | (1) ACD |
Lanjan'ny molekiola | 367.36 |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Mifandraika mifandraika
NY FANANANA | sarobidy | toe-javatra | Source |
Faritra misy polar | 147 A2 | (1) ACD |
(1) kajy amin'ny fampandrosoana ny simika Advanced (ACD / Labs) rindrambaiko V11.02 (© 1994-2023 ACD / Labs)
Spectra misy
1H NMR
Spectra misy
13c NMR