Ui |
unsaturation index |
Hy |
hydrophilic factor |
AMR |
molar refractivity |
TPSA(NO) |
topological polar surface area using N, O polar contributions |
TPSA(tot) |
topological polar surface area using N, O, S, P polar contributions |
MLogP |
Moriguchi octanol-water partition coefficient |
MLOGP2 |
Squared Moriguchi octanol-water partition coeff. (logP^2) |
ALOGP |
Ghose-Crippen octanol-water partition coeff. (logP) |
ALOGP2 |
Squared Ghose-Crippen octanol-water partition coeff. (logP^2) |
LAI |
Lipinski alert index |
GVWAI-80 |
Ghose-Viswanadhan-Wendoloski drug-like index at 80% |
GVWAI-50 |
Ghose-Viswanadhan-Wendoloski drug-like index at 50% |
Inflammat-80 |
Ghose-Viswanadhan-Wendoloski antiinflammatory-like index at 80% |
Inflammat-50 |
Ghose-Viswanadhan-Wendoloski antiinflammatory-like index at 50% |
Depressant-80 |
Ghose-Viswanadhan-Wendoloski antidepressant-like index at 80% |
Depressant-50 |
Ghose-Viswanadhan-Wendoloski antidepressant-like index at 50% |
Psychotic-80 |
Ghose-Viswanadhan-Wendoloski antipsychotic-like index at 80% |
Psychotic-50 |
Ghose-Viswanadhan-Wendoloski antipsychotic-like index at 50% |
Hypertens-80 |
Ghose-Viswanadhan-Wendoloski antihypertensive-like index at 80% |
Hypertens-50 |
Ghose-Viswanadhan-Wendoloski antihypertensive-like index at 50% |
Hypnotic-80 |
Ghose-Viswanadhan-Wendoloski hypnotic-like index at 80% |
Hypnotic-50 |
Ghose-Viswanadhan-Wendoloski hypnotic-like index at 50% |
Neoplastic-80 |
Ghose-Viswanadhan-Wendoloski antineoplastic-like index at 80% |
Neoplastic-50 |
Ghose-Viswanadhan-Wendoloski antineoplastic-like index at 50% |
Infective-80 |
Ghose-Viswanadhan-Wendoloski antiinfective-like index at 80% |
Infective-50 |
Ghose-Viswanadhan-Wendoloski antiinfective-like index at 50% |
BLTF96 |
Verhaar model of Fish base-line toxicity for Fish (96h) from MLOGP (mmol/l) |
BLTD48 |
Verhaar model of Daphnia base-line toxicity for Daphnia (48h) from MLOGP (mmol/l) |
BLTA96 |
Verhaar model of Algae base-line toxicity for Algae (96h) from MLOGP (mmol/l) |