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 | |||||||||
164.766 | 6.337 | 576.847 | 4 | 6 | 9 | 5 | 0 | 0.16 |
Energy | Prediction | Applicability | Probablity | Enrichment | Score | ||||||
164.766 | Non-Mutagen | All properties and OPS components are within expected ranges. | 0 | 0 | -97.3471 |
Energy |
164.766 |
|
Solubility |
-5.55 |
|
Solubility_Level |
2 |
|
Unknown_AlogP98 |
0 |
|
BBB_Level |
||
EXT_CYP2D6 |
4 |
|
Prediction |
-7.90358 |
|
Applicability |
||
Applicability_MD |
All properties and OPS components are within expected ranges. |
|
Applicability_Mdpvalue |
10.8819 |
|
Hepatotoxic |
0.0274973 |
|
Hepatotoxic Prediction |
-16.1354 |
|
Hepatotoxic_Applicability |
||
Hepatotoxic_Applicability MD |
All properties and OPS components are within expected ranges. | |
Hepatotoxic_Applicability MDpvalue |
10.9746 | |
Absorption_Level |
0.00671698 | |
EXT_PPB |
2 | |
EXT_PPB Prediction |
-9.88278 | |
PPB_Applicability |
||
PPB_Applicability MD |
All properties and OPS components are within expected ranges. | |
PPB_Applicability Mdpvalue |
12.9011 | |
ADMET_AlogP98 |
0.00782087 | |
ADMET_PSA_2D |
6.337 | |
ADMET_BBB |
101.122 |
Energy |
Energy/LEHA |
164.766 |
4.01868 |