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. : | 1094-61-7 | MDL No. : | |
Formula : | C11H15N2O8P | Boiling Point : | - |
Linear Structure Formula : | - | InChI Key : | DAYLJWODMCOQEW-TURQNECASA-N |
M.W : | 334.22 | Pubchem ID : | 14180 |
Synonyms : |
β-NM;NMN;Nicotinamide Mononucleotide;β-NMN
|
Num. heavy atoms : | 22 |
Num. arom. heavy atoms : | 6 |
Fraction Csp3 : | 0.45 |
Num. rotatable bonds : | 5 |
Num. H-bond acceptors : | 8.0 |
Num. H-bond donors : | 4.0 |
Molar Refractivity : | 69.19 |
TPSA : | 176.06 Ų |
GI absorption : | Low |
BBB permeant : | No |
P-gp substrate : | Yes |
CYP1A2 inhibitor : | No |
CYP2C19 inhibitor : | No |
CYP2C9 inhibitor : | No |
CYP2D6 inhibitor : | No |
CYP3A4 inhibitor : | No |
Log Kp (skin permeation) : | -10.75 cm/s |
Log Po/w (iLOGP) : | -9.5 |
Log Po/w (XLOGP3) : | -3.4 |
Log Po/w (WLOGP) : | -2.08 |
Log Po/w (MLOGP) : | -2.52 |
Log Po/w (SILICOS-IT) : | -2.93 |
Consensus Log Po/w : | -4.09 |
Lipinski : | 0.0 |
Ghose : | None |
Veber : | 1.0 |
Egan : | 1.0 |
Muegge : | 2.0 |
Bioavailability Score : | 0.11 |
Log S (ESOL) : | 0.36 |
Solubility : | 762.0 mg/ml ; 2.28 mol/l |
Class : | Highly soluble |
Log S (Ali) : | 0.28 |
Solubility : | 636.0 mg/ml ; 1.9 mol/l |
Class : | Highly soluble |
Log S (SILICOS-IT) : | 1.45 |
Solubility : | 9330.0 mg/ml ; 27.9 mol/l |
Class : | Soluble |
PAINS : | 0.0 alert |
Brenk : | 2.0 alert |
Leadlikeness : | 0.0 |
Synthetic accessibility : | 4.13 |
Signal Word: | Warning | Class: | N/A |
Precautionary Statements: | P261-P305+P351+P338 | UN#: | N/A |
Hazard Statements: | 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.