. Author manuscript; available in PMC: 2020 May 23.

Published in final edited form as: J Med Chem. 2018 Dec 27;62(10):4851–4883. doi: 10.1021/acs.jmedchem.8b00843

Table 3:

The calculated physicochemical properties of approved NNRTI drugs.

Generic	Properties
Generic	MW	PSA	cLogP	HBA	HBD	NrotB
Nevirapine	266.30	58.12	2.05	3	1	1
Delavirdine	456.56	118.81	−0.06	4	3	6
Efavirenz	315.67	38.33	3.68	2	1	2
Etravirine	435.28	120.64	6.11	5	2	5
Rilprivine	366.42	97.42	5.64	4	2	6
Doravirine	425.74	104.42	3.47	6	1	5

The calculated physicochemical properties of the approved drugs are provided. The values are calculated from Canvas tool (Canvas, Schrödinger, LLC, New York, NY, 2016).