	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	41669-40-3	37,3	-3,699	228,374	5,1537	2	1	1	-25,216	0,1153006
	41703-38-2	57,53	-1,886	224,299	1,2788	3	2	0	-1,9339	0,3210367
	41744-44-9	29,46	-4,638	345,663	4,6416	2	1	0	-6,1979	0,0382114
	4176-06-1	0	-3,807	202,34	5,3623	0	0	1	-4,976	0,1485215
	4176-17-4	0	-3,807	202,34	5,3623	0	0	1	-4,976	0,1485215
	41833-13-0	86,28	-1,664	169,136	-0,205	5	2	0	-7,4305	0,4858199
	41841-34-3	81,78	-2,731	385,051	0,8271	5	2	0	-10,372	0,1633573
	41846-88-2	110,38	0,251	180,155	-2,6781	6	5	0	-2,8163	0,521174
	41846-89-3	110,38	0,251	180,155	-2,6781	6	5	0	-2,8163	0,521174
	41870-24-0	75,28	-1,978	183,162	0,0707	5	1	0	-7,0745	0,48173
	4192-14-7	92,78	-5,574	525,071	0,3749	5	3	1	-10,339	0,2411968
	41935-71-1	49,33	-1,158	125,127	-0,4242	3	2	0	-0,05514	0,7296562
	41936-89-4	43,37	-4,123	575,465	3,8605	3	0	1	-25,389	0,0521392
	41948-36-1	48,58	-0,662	209,225	0,1071	4	0	0	-35,387	0,4875981
	419572-94-4	105,45	-4,882	492,65	3,2447	7	3	0	-1,9919	0,3019053
	419573-86-7	40,46	-3,297	364,504	3,3018	2	2	0	-8,9502	0,0675371
	419573-87-8	40,46	-3,297	364,504	3,3018	2	2	0	-7,1823	0,0675797
	419573-88-9	37,3	-3,348	362,488	3,2706	2	1	0	-10,241	0,0675516
	4198-47-4	186,21	1,911	258,118	-8,5713	9	4	0	-11,192	0,4867574
	41994-45-0	38,33	-1,106	143,185	0,2208	3	1	0	-2,2811	0,534974