	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	139579-30-9	60,69	-3,399	322,487	4,3721	3	3	0	-21,96	0,3582536
	139579-31-0	46,53	-3,862	318,455	3,9829	3	1	0	-22,045	0,3616148
	139579-32-1	32,76	-3,88	304,472	4,9585	2	1	0	-24,113	0,1900099
	139594-87-9	139,59	-5,411	616,789	4,9444	9	3	1	-4,121	0,1610195
	139610-22-3	29,46	-3,845	313,234	3,5771	2	1	0	-4,3182	0,2299486
	139629-08-6	78,9	-2,183	258,269	1,1148	6	0	0	-3,2393	0,48614
	139629-09-7	78,9	-2,183	258,269	1,1148	6	0	0	-3,2393	0,48614
	139629-10-0	78,9	-2,183	258,269	1,1148	6	0	0	-3,2393	0,48614
	13963-13-8	17,07	-6,222	396,656	7,2923	1	0	1	-1,4659	0,0847814
	139680-61-8	124,65	-3,248	439,663	3,7395	6	4	0	-6,3239	0,3452819
	139683-17-3	78,9	-2,183	258,269	1,1148	6	0	0	-3,2393	0,48614
	139694-47-6	17,07	-3,493	232,366	4,4596	1	0	0	-26,396	0,0838177
	139722-80-8	20,23	-5,271	292,505	7,0489	1	1	1	-22,755	0,1918889
	139722-81-9	20,23	-5,583	318,543	7,7055	1	1	1	-19,885	0,1712346
	139722-82-0	20,23	-5,431	306,532	7,2672	1	1	1	-12,056	0,182079
	139722-83-1	20,23	-5,743	332,57	7,9238	1	1	1	-12,056	0,1634519
	139729-95-6	57,53	-6,81	426,723	10,039	3	2	1	-19,892	0,1224525
	139742-31-7	16,38	-3,255	273,418	3,6225	2	0	0	-0,33636	0,5714186
	139742-32-8	30,21	-1,086	289,417	2,7369	3	0	0	-9,8308	0,4543532
	139742-33-9	13,14	-3,717	216,323	3,9456	1	0	0	-3,0497	0,3991858