	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	88526-73-2	62,22	-3,159	334,454	3,9504	4	2	0	-4,6008	0,2308312
	88547-15-3	58,2	-0,442	128,131	-1,3707	4	2	0	3,0873	0,9667346
	88586-17-8	20,23	-4,239	288,473	6,6361	1	1	1	-4,3333	0,2385595
	88640-21-5	60,69	-5,87	460,74	6,4533	3	3	1	-0,53459	0,213054
	88640-88-4	57,53	-4,578	318,455	6,3047	3	2	1	-15,308	0,2309061
	88643-48-5	59,06	-3,758	334,454	3,6215	4	1	0	-9,2528	0,2251538
	886847-35-4	77,76	-3,381	334,454	4,5755	4	3	0	-13,059	0,3457847
	886851-26-9	20,23	-6,399	400,688	7,4008	1	1	1	-1,7885	0,1310643
	886984-47-0	63,6	-3,576	320,427	4,2575	4	1	0	-6,1883	0,3597646
	886984-48-1	55,76	-3,571	346,465	4,5987	4	1	0	-6,1035	0,3371789
	88704-36-3	64,7	-3,879	328,168	2,9582	4	3	0	-1,2849	0,379645
	88704-39-6	64,7	-3,045	249,272	2,233	4	3	0	0,50507	0,5772763
	88704-44-3	41,04	-4,831	314,185	3,1349	3	1	0	-1,4022	0,3278389
	88704-49-8	61,27	-4,535	330,184	2,7892	4	2	0	-1,4775	0,3429384
	88704-51-2	99,81	-3,749	370,27	1,3002	5	3	0	0,74451	0,5380123
	88704-52-3	79,58	-4,045	354,271	1,6459	4	2	0	0,72496	0,5247345
	88704-55-6	79,58	-4,045	354,271	1,6459	4	2	0	0,72496	0,5247345
	887141-45-9	237,45	-4,294	805,008	1,1868	15	9	3	-5,5991	0,2123944
	887141-47-1	237,45	-3,796	788,965	0,4802	15	9	3	0,13808	0,3477355
	887332-06-1	134,66	-4,219	540,991	1,3864	10	1	1	-1,3518	0,0448238