Alternatived Products of [ 12266-92-1 ]
Product Details of [ 12266-92-1 ]
CAS No. : | 12266-92-1 |
MDL No. : | MFCD00064719 |
Formula : |
C10H18Pt
|
Boiling Point : |
No data available |
Linear Structure Formula : | - |
InChI Key : | AYLJSSIIYOOUOG-PHFPKPIQSA-N |
M.W : |
333.33
|
Pubchem ID : | 10882173 |
Synonyms : |
|
Calculated chemistry of [ 12266-92-1 ] Expand+
Physicochemical Properties
Num. heavy atoms : |
11 |
Num. arom. heavy atoms : |
0 |
Fraction Csp3 : |
0.6 |
Num. rotatable bonds : |
0 |
Num. H-bond acceptors : |
0.0 |
Num. H-bond donors : |
0.0 |
Molar Refractivity : |
49.24 |
TPSA : |
0.0 ?2 |
Pharmacokinetics
GI absorption : |
Low |
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) : |
-5.17 cm/s |
Lipophilicity
Log Po/w (iLOGP) : |
0.0 |
Log Po/w (XLOGP3) : |
4.46 |
Log Po/w (WLOGP) : |
3.84 |
Log Po/w (MLOGP) : |
3.27 |
Log Po/w (SILICOS-IT) : |
2.28 |
Consensus Log Po/w : |
2.77 |
Druglikeness
Lipinski : |
0.0 |
Ghose : |
None |
Veber : |
0.0 |
Egan : |
0.0 |
Muegge : |
1.0 |
Bioavailability Score : |
0.55 |
Water Solubility
Log S (ESOL) : |
-4.72 |
Solubility : |
0.0064 mg/ml ; 0.0000192 mol/l |
Class : |
Moderately soluble |
Log S (Ali) : |
-4.18 |
Solubility : |
0.0221 mg/ml ; 0.0000662 mol/l |
Class : |
Moderately soluble |
Log S (SILICOS-IT) : |
-1.1 |
Solubility : |
26.3 mg/ml ; 0.0789 mol/l |
Class : |
Soluble |
Medicinal Chemistry
PAINS : |
0.0 alert |
Brenk : |
1.0 alert |
Leadlikeness : |
1.0 |
Synthetic accessibility : |
3.43 |