Purity | Size | Price | VIP Price | USA Stock *0-1 Day | Global Stock *5-7 Days | Quantity | |||||
{[ item.p_purity ]} | {[ item.pr_size ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} |
{[ getRatePrice(item.pr_usd, 1,1) ]} | {[ getRatePrice(item.pr_usd,item.pr_rate,item.mem_rate) ]} {[ getRatePrice(item.pr_usd,1,item.mem_rate) ]} | {[ item.pr_usastock ]} | Inquiry - | {[ item.pr_chinastock ]} | Inquiry - |
* Storage: {[proInfo.prStorage]}
CAS No. : | 13566-48-8 | MDL No. : | MFCD06657567 |
Formula : | C7H10N2O2 | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | FWQJAXMTUACMLK-UHFFFAOYSA-N |
M.W : | 154.17 | Pubchem ID : | 11040904 |
Synonyms : |
|
Num. heavy atoms : | 11 |
Num. arom. heavy atoms : | 6 |
Fraction Csp3 : | 0.43 |
Num. rotatable bonds : | 2 |
Num. H-bond acceptors : | 4.0 |
Num. H-bond donors : | 0.0 |
Molar Refractivity : | 39.98 |
TPSA : | 44.24 Ų |
GI absorption : | High |
BBB permeant : | Yes |
P-gp substrate : | No |
CYP1A2 inhibitor : | Yes |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -6.38 cm/s |
Log Po/w (iLOGP) : | 2.48 |
Log Po/w (XLOGP3) : | 1.21 |
Log Po/w (WLOGP) : | 0.8 |
Log Po/w (MLOGP) : | 0.24 |
Log Po/w (SILICOS-IT) : | 1.28 |
Consensus Log Po/w : | 1.2 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 0.0 |
Egan : | 0.0 |
Muegge : | 1.0 |
Bioavailability Score : | 0.55 |
Log S (ESOL) : | -1.83 |
Solubility : | 2.28 mg/ml ; 0.0148 mol/l |
Class : | Very soluble |
Log S (Ali) : | -1.74 |
Solubility : | 2.83 mg/ml ; 0.0184 mol/l |
Class : | Very soluble |
Log S (SILICOS-IT) : | -2.28 |
Solubility : | 0.811 mg/ml ; 0.00526 mol/l |
Class : | Soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 1.0 |
Synthetic accessibility : | 1.97 |
Signal Word: | Warning | Class: | N/A |
Precautionary Statements: | P261-P305+P351+P338 | UN#: | N/A |
Hazard Statements: | H302-H315-H319-H335 | Packing Group: | N/A |
GHS Pictogram: |
![]() |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
[ 36315-01-2 ]
2-Amino-4,6-dimethoxypyrimidine
Similarity: 0.80
[ 128276-50-6 ]
4,6-Dimethoxypyrimidine-2-carboxylic acid
Similarity: 0.80
[ 13566-63-7 ]
4,6-Dimethoxy-5-methylpyrimidine
Similarity: 0.79
[ 40497-30-1 ]
2-Methylpyrimidine-4,6(1H,5H)-dione
Similarity: 0.90
[ 3709-98-6 ]
2-Ethyl-4,6-dihydroxypyrimidine
Similarity: 0.83
[ 1194-74-7 ]
4(1H)-Pyrimidinone,6-hydroxy-2,5-dimethyl-
Similarity: 0.82
[ 36315-01-2 ]
2-Amino-4,6-dimethoxypyrimidine
Similarity: 0.80