INDIAN MEDICINAL PHYTOCHEMICAL DATABASE
Developed Under an Indian Council of Medical Research Funded Project
(Govt. Of India, Sanction No:BIC/12(31)/2013)
Energy | AlgoP | Mw | HBD | HBA | NRB | #Ring | #Aromatic Rings | PSA | |||||||||
25.2342 | 5.48 | 228.371 | 1 | 2 | 12 | 0 | 0 | 0.13 |
Energy | Prediction | Applicability | Probablity | Enrichment | Score | ||||||
25.0106 | Non-Mutagen | All properties and OPS components are within expected ranges. | 2.86369E-6 | 5.12864E-6 | -43.4879 |
Energy |
25.2342 |
|
Solubility |
-4.037 |
|
Solubility_Level |
2 |
|
Unknown_AlogP98 |
0 |
|
BBB_Level |
0.937 |
|
EXT_CYP2D6 |
0 |
|
Prediction |
-1.84935 |
|
Applicability |
||
Applicability_MD |
All properties and OPS components are within expected ranges. |
|
Applicability_Mdpvalue |
11.0911 |
|
Hepatotoxic |
0.0186637 |
|
Hepatotoxic Prediction |
-23.3587 |
|
Hepatotoxic_Applicability |
||
Hepatotoxic_Applicability MD |
All properties and OPS components are within expected ranges. | |
Hepatotoxic_Applicability MDpvalue |
5.84326 | |
Absorption_Level |
0.999994 | |
EXT_PPB |
0 | |
EXT_PPB Prediction |
2.52518 | |
PPB_Applicability |
1 | |
PPB_Applicability MD |
All properties and OPS components are within expected ranges. | |
PPB_Applicability Mdpvalue |
8.9891 | |
ADMET_AlogP98 |
0.996895 | |
ADMET_PSA_2D |
5.48 | |
ADMET_BBB |
38.116 |
Energy |
Energy/LEHA |
25.2342 |
1.57714 |