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) ]} | Inquiry {[ 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. : | 5270-94-0 | MDL No. : | MFCD00955844 |
Formula : | C6H8N2O2 | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | FPSPPRZKBUVEJQ-UHFFFAOYSA-N |
M.W : | 140.14 | Pubchem ID : | 259821 |
Synonyms : |
|
Num. heavy atoms : | 10 |
Num. arom. heavy atoms : | 6 |
Fraction Csp3 : | 0.33 |
Num. rotatable bonds : | 2 |
Num. H-bond acceptors : | 4.0 |
Num. H-bond donors : | 0.0 |
Molar Refractivity : | 35.02 |
TPSA : | 44.24 Ų |
GI absorption : | High |
BBB permeant : | Yes |
P-gp substrate : | No |
CYP1A2 inhibitor : | No |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -6.47 cm/s |
Log Po/w (iLOGP) : | 1.57 |
Log Po/w (XLOGP3) : | 0.96 |
Log Po/w (WLOGP) : | 0.49 |
Log Po/w (MLOGP) : | -0.11 |
Log Po/w (SILICOS-IT) : | 0.85 |
Consensus Log Po/w : | 0.75 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 0.0 |
Egan : | 0.0 |
Muegge : | 1.0 |
Bioavailability Score : | 0.55 |
Log S (ESOL) : | -1.63 |
Solubility : | 3.32 mg/ml ; 0.0237 mol/l |
Class : | Very soluble |
Log S (Ali) : | -1.48 |
Solubility : | 4.68 mg/ml ; 0.0334 mol/l |
Class : | Very soluble |
Log S (SILICOS-IT) : | -1.88 |
Solubility : | 1.84 mg/ml ; 0.0132 mol/l |
Class : | Soluble |
PAINS : | 0.0 alert |
Brenk : | 0.0 alert |
Leadlikeness : | 1.0 |
Synthetic accessibility : | 1.72 |
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: 0.90
[ 13566-63-7 ]
4,6-Dimethoxy-5-methylpyrimidine
Similarity: 0.88
[ 13566-48-8 ]
2-Methyl-4,6-dimethoxypyrimidine
Similarity: 0.88
[ 15846-15-8 ]
4,6-Dimethoxypyrimidin-5-amine
Similarity: 0.81
[ 4558-59-2 ]
4,6-Dimethoxypyrimidine-5-carbaldehyde
Similarity: 0.80
[ 36315-01-2 ]
2-Amino-4,6-dimethoxypyrimidine
Similarity: 0.90
[ 13566-63-7 ]
4,6-Dimethoxy-5-methylpyrimidine
Similarity: 0.88
[ 13566-48-8 ]
2-Methyl-4,6-dimethoxypyrimidine
Similarity: 0.88
[ 15846-15-8 ]
4,6-Dimethoxypyrimidin-5-amine
Similarity: 0.81