20. Molecular properties
Definition
Relevant descriptors
Molecular property descriptors calculated from models together with some empirical descriptors.
| No. | Descriptor |
| 1 | unsaturation index |
| 2 | hydrophilic factor |
| 3 | Ghose-Crippen molar refractivity |
| 4 | fragment-based polar surface area from N,O polar coefficients) |
| 5 | fragment-based polar surface area from N,O,S,P polar coefficients) |
| 6 | Moriguchi octanol-water partition coefficient (MLOGP) |
| 7 | Squared Moriguchi octanol-water partition coefficient (MLOGP^2) |
| 8 | Ghose-Crippen octanol-water partition coefficient (ALOGP) |
| 9 | Squared Ghose-Crippen octanol-water partition coefficient (ALOGP^2) |
| 10 | Lipinski Alert index |
| 11 | Ghose-Viswanadhan-Wendoloski drug-like (covering 80%) |
| 12 | Ghose-Viswanadhan-Wendoloski drug-like (covering 50%) |
| 13 | Ghose-Viswanadhan-Wendoloski antiinflammatory (covering 80%) |
| 14 | Ghose-Viswanadhan-Wendoloski antiinflammatory (covering 50%) |
| 15 | Ghose-Viswanadhan-Wendoloski antidepressant (covering 80%) |
| 16 | Ghose-Viswanadhan-Wendoloski antidepressant (covering 50%) |
| 17 | Ghose-Viswanadhan-Wendoloski antipsychotic (covering 80%) |
| 18 | Ghose-Viswanadhan-Wendoloski antipsychotic (covering 50%) |
| 19 | Ghose-Viswanadhan-Wendoloski antihypertensive (covering 80%) |
| 20 | Ghose-Viswanadhan-Wendoloski antihypertensive (covering 50%) |
| 21 | Ghose-Viswanadhan-Wendoloski hypnotic (covering 80%) |
| 22 | Ghose-Viswanadhan-Wendoloski hypnotic (covering 50%) |
| 23 | Ghose-Viswanadhan-Wendoloski antineoplastic (covering 80%) |
| 24 | Ghose-Viswanadhan-Wendoloski antineoplastic (covering 50%) |
| 25 | Ghose-Viswanadhan-Wendoloski antiinfective (covering 80%) |
| 26 | Ghose-Viswanadhan-Wendoloski antiinfective (covering 50%) |
