	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	54462-54-3	40,46	-4,478	432,622	4,255	2	2	0	-9,9443	0,0665424
	544-62-7	49,69	-4,589	344,577	6,661	3	2	1	-25,055	0,1299318
	544-63-8	37,3	-3,699	228,374	5,1537	2	1	1	-25,216	0,1153006
	544-66-1	37,3	-3,471	226,358	4,9015	2	1	0	-24,851	0,3409291
	544-84-3	37,3	-6,711	394,681	10,354	2	1	1	-28,971	0,128856
	54502-93-1	49,69	-3,004	325,983	2,6555	3	2	0	-5,4948	0,4264845
	54527-00-3	43,37	-4,019	284,438	5,4374	3	0	1	-33,901	0,2901077
	54527-07-0	43,37	-4,019	284,438	5,4374	3	0	1	-29,087	0,2901077
	54537-22-3	44,45	-4,238	263,448	5,4828	1	0	1	-9,5785	0,1446071
	54537-30-3	74,6	-1,479	166,132	-0,0912	4	2	0	-7,8262	0,4871171
	545434-89-7	278,91	-2,393	718,802	-2,9267	17	12	3	0,66377	0,4277507
	545-47-1	20,23	-6,803	426,726	7,6469	1	1	1	-22,172	0,1298172
	54563-87-0	57,53	-6	384,642	8,6759	3	2	1	-19,892	0,1462561
	5457-28-3	39,58	-2,914	142,161	1,5346	2	1	0	-4,7762	0,4659538
	54584-28-0	58,16	-3,461	191,253	1,5421	2	1	0	0,8241	0,7517487
	54594-22-8	55,76	-1,921	216,276	0,9067	4	1	0	-7,4847	0,477464
	54594-23-9	55,76	-1,921	216,276	0,9067	4	1	0	-7,4847	0,477464
	54602-07-2	26,3	-6,508	414,671	7,1879	2	0	1	-0,82392	0,11045
	54602-14-1	20,23	-6,258	386,661	6,9216	1	1	1	-1,6216	0,1800806
	54602-15-2	20,23	-6,326	374,65	6,9555	1	1	1	-2,8042	0,1633455