	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	81275-81-2	20,23	-6,011	384,645	6,9303	1	1	1	-0,27669	0,2297797
	81275-82-3	20,23	-6,295	412,699	7,755	1	1	1	-1,7867	0,1281241
	81276-10-0	37,3	-4,947	332,526	7,7801	2	1	1	-21,49	0,1883733
	81296-42-6	369,49	-4,553	1179,33	-0,2528	25	9	3	-3,9146	0,1228209
	81306-52-7	70,06	-8,171	598,865	10,094	4	2	2	-1,9489	0,0907769
	81306-58-3	20,23	-6,578	424,71	8,4077	1	1	1	-1,8612	0,0704138
	81306-59-4	20,23	-6,314	422,694	8,3032	1	1	1	-1,7958	0,0922734
	81306-60-7	20,23	-7,106	428,742	8,6167	1	1	1	-2,4556	0,0783234
	81306-61-8	20,23	-6,749	426,726	8,6236	1	1	1	-4,9954	0,1265006
	81325-64-6	57,53	-3,696	294,433	5,1929	3	2	1	-18,339	0,2492429
	813436-40-7	43,37	-4,989	372,547	4,6773	3	0	0	1,1901	0,4776683
	813436-41-8	43,37	-4,937	358,52	4,3639	3	0	0	-0,55624	0,3944651
	813436-42-9	34,14	-5,978	398,628	6,1023	2	0	1	1,108	0,3085156
	81344-95-8	0	-3,864	202,34	5,2943	0	0	1	-18,148	0,3091013
	81345-02-0	20,23	-2,493	180,29	3,8379	1	1	0	-9,4057	0,4193915
	813461-20-0	89,87	-1,284	276,291	-0,344	6	3	0	7,3385	0,9539723
	813461-21-1	89,87	-1,284	276,291	-0,344	6	3	0	7,3385	0,9539723
	81346-95-4	46,53	-4,98	338,53	6,8744	3	1	1	-18,581	0,1997332
	81346-96-5	46,53	-5,604	390,605	8,1876	3	1	1	-22,682	0,1572378
	81346-97-6	46,53	-5,916	416,643	8,8442	3	1	1	-22,682	0,142029