	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	851318-94-0	99,52	-4,697	488,662	3,6916	6	3	0	-2,4774	0,1744854
	851318-95-1	99,52	-4,988	502,689	4,3647	6	3	1	-9,3544	0,2317823
	851318-96-2	99,52	-5,085	504,705	4,1621	6	3	1	-9,7417	0,2332029
	851318-97-3	99,52	-5,355	518,732	4,6165	6	3	1	-6,1468	0,2036837
	851319-98-7	145,66	-4,655	585,088	3,1949	10	2	1	1,32	0,0540175
	851319-99-8	145,66	-4,883	587,103	3,4471	10	2	1	1,0051	0,049349
	851320-00-8	125,43	-4,415	520,617	3,6997	9	1	1	-0,68529	0,3520226
	851369-86-3	134,02	-4,185	457,521	2,4903	8	3	0	-3,8248	0,3380141
	851473-80-8	0	-4,319	364,935	4,6299	0	0	0	-9,1954	0,0524839
	851473-81-9	26,3	-4,003	388,526	3,9774	2	0	0	-10,501	0,0581277
	851473-82-0	26,3	-4,003	388,526	3,8621	2	0	0	-6,4979	0,0589453
	851473-83-1	26,3	-4,003	388,526	3,8621	2	0	0	-6,4979	0,0589453
	851539-00-9	178,42	-3,774	594,651	1,3016	12	3	2	-11,02	0,0783918
	851539-01-0	186,12	-4,232	624,721	2,6778	12	4	2	-20,481	0,2377587
	851539-02-1	186,12	-3,152	568,614	0,8602	12	4	2	1,2433	0,5358174
	851539-03-2	212,42	-4,243	682,757	2,1406	14	4	2	-22,846	0,1799283
	851539-04-3	212,42	-4,513	696,784	2,595	14	4	2	-21,646	0,2107649
	851596-25-3	192,06	-7,388	901,139	5,1382	14	5	3	-3,8042	0,0490931
	851606-66-1	212,29	-7,82	959,219	5,6983	15	6	4	-5,5146	0,0709231
	851606-67-2	221,52	-8,145	975,218	5,9004	16	6	4	-5,5146	0,0146022