	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	549521-30-4	156,36	-3,488	370,32	-0,8458	10	4	0	0,47667	0,6704318
	549528-38-3	106,97	-6,047	560,769	5,3873	7	1	2	-6,2518	0,052861
	54971-26-5	17,07	-2,226	257,952	2,3437	1	0	0	-22,758	0,1404542
	54976-67-9	44,76	-2,961	206,196	1,6526	4	0	0	-5,1536	0,1763341
	54985-16-9	186,37	-2,446	448,379	0,00070003	11	7	2	-3,2535	0,4110516
	54990-54-4	9,23	-3,286	220,355	3,4965	1	0	0	-5,9751	0,1986259
	54990-55-5	9,23	-3,286	220,355	3,4965	1	0	0	-8,0252	0,1981884
	550-21-0	427,27	-3,691	966,148	-4,2224	23	12	3	8,9681	0,4484422
	55022-57-6	93,06	-4,07	410,549	4,5616	6	2	0	-25,041	0,3011472
	550-24-3	74,6	-3,684	294,389	4,069	4	2	0	-16,227	0,3689148
	55027-78-6	33,02	-3,953	304,969	3,0451	2	0	0	-10,775	0,390159
	5502-94-3	37,3	-3,859	242,401	5,372	2	1	1	-11,172	0,3026758
	550-29-8	0	-8,808	528,821	13,608	0	0	2	0,181	0,0502485
	5502-99-8	20,23	-2,296	154,252	2,5392	1	1	0	-4,3326	0,3741118
	5503-12-8	17,07	-2,247	150,22	2,2224	1	0	0	-24,903	0,2804013
	55035-53-5	49,69	-5,041	444,59	3,7705	3	2	0	-11,258	0,0631791
	55-03-8	92,78	-7,606	776,855	1,2491	5	3	1	-10,339	0,1366629
	55038-27-2	38,83	-3,741	316,439	5,0169	3	0	1	-0,44057	0,2111108
	55044-54-7	26,3	-4,299	282,466	6,4565	2	0	1	-26,355	0,2394787
	55051-78-0	57,53	-6,135	446,713	6,4279	3	2	1	-2,9906	0,1607795