	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	171438-67-8	59,67	-5,199	400,557	6,5375	4	1	1	-1,1392	0,2342689
	171440-23-6	60,44	-3,116	312,364	2,6113	4	0	0	-18	0,4260959
	171440-24-7	102,29	-4,953	492,65	4,3787	7	2	0	-23,221	0,2373578
	171485-62-4	38,33	-4,883	367,959	3,9422	3	1	0	-0,99137	0,0501771
	171485-63-5	38,33	-4,883	367,959	3,9422	3	1	0	-0,99137	0,0501771
	171485-64-6	78,9	-4,284	430,539	4,6723	6	0	0	1,9833	0,3161004
	171528-02-2	96,22	-4,759	478,667	4,1393	6	3	0	-19,393	0,2595966
	171528-03-3	93,06	-4,81	476,651	4,1081	6	2	0	-21,038	0,2594605
	171528-04-4	82,06	-5,189	476,651	4,8107	6	1	0	-27,303	0,2205168
	171528-05-5	75,99	-5,158	462,668	5,2482	5	2	1	-20,002	0,2114046
	171565-08-5	58,2	-5,469	420,06	2,6178	4	2	0	1,3386	0,5119615
	1715-86-2	20,23	-5,711	382,629	7,2139	1	1	1	-2,8967	0,083146
	171674-92-3	132,56	-6,71	689,63	5,2542	10	2	2	3,8471	0,1344222
	171743-40-1	151,98	-7,009	722,997	9,4029	10	4	2	-29,047	0,0752925
	171784-01-3	98,05	-4,196	447,494	2,4021	9	1	0	3,3448	0,6628458
	171784-09-1	46,53	-5,471	426,638	5,6491	3	1	1	-3,6087	0,2036034
	171784-10-4	46,53	-5,699	428,654	5,9013	3	1	1	-10,322	0,1826049
	17181-88-3	46,53	-6,25	444,697	6,815	3	1	1	-1,5244	0,1704872
	171828-75-4	20,23	-4,776	294,521	6,2182	1	1	1	-8,5501	0,1836426
	171864-80-5	74,43	-3,485	381,474	2,8997	6	2	0	7,0204	0,4658145