	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	116079-55-1	66,76	-3,506	336,47	2,5305	4	2	0	-7,8504	0,3277783
	116079-56-2	61,83	-4,221	376,491	3,9051	5	0	0	-5,8082	0,335439
	116079-57-3	82,06	-3,822	392,49	3,053	6	1	0	-3,0954	0,3849426
	116079-58-4	88,13	-4,232	434,527	3,5376	7	0	0	-4,0644	0,3269505
	116084-98-1	46,53	-3,908	332,482	6,0252	3	1	1	-23,672	0,2599865
	116102-40-0	108,36	-3,833	450,526	2,6855	8	1	0	-1,3868	0,4151388
	116107-37-0	20,23	-10,455	546,836	12,515	1	1	2	-4,6984	0,0863743
	116-16-5	17,07	-3,308	264,75	3,2676	1	0	0	-7,5399	0,0716657
	116169-29-0	17,07	-6,574	412,699	7,9847	1	0	1	-8,3293	0,1336046
	116173-37-6	43,37	-4,37	260,332	3,4345	3	0	0	-3,0615	0,2302666
	116173-38-7	46,53	-3,641	262,348	3,2593	3	1	0	-2,4827	0,4352136
	116173-39-8	52,6	-4,051	304,385	3,7439	4	0	0	-2,5755	0,3917336
	116173-40-1	37,3	-3,875	232,322	3,7096	2	1	0	-2,8927	0,4039739
	116173-41-2	26,3	-4,189	246,349	3,9853	2	0	0	-2,7835	0,3793262
	116179-22-7	20,23	-6,399	400,688	7,4008	1	1	1	-8,1908	0,1146729
	116179-73-8	82,06	-3,822	392,49	3,053	6	1	0	-3,0954	0,3849426
	116180-16-6	0	-10,626	528,821	13,091	0	0	2	-5,4329	0,08913
	116180-17-7	57,53	-3,78	318,455	5,5973	3	2	1	-13,059	0,2848744
	116199-48-5	201,15	-7,016	927,185	3,7523	13	6	3	-7,0375	0,0749709
	116199-49-6	201,15	-7,176	941,211	4,0216	13	6	3	-7,1454	0,0717677