	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	76758-18-4	20,23	-6,426	412,699	7,8148	1	1	1	-11,207	0,1371826
	76758-19-5	20,23	-6,696	426,726	8,2692	1	1	1	-7,4502	0,1277879
	76758-20-8	17,07	-6,477	410,683	7,9585	1	0	1	-12,752	0,1357118
	76758-21-9	20,23	-6,523	414,715	7,841	1	1	1	-7,8722	0,1350018
	76819-10-8	194,21	0,142	340,28	-4,6181	11	7	2	-3,4482	0,4809462
	76822-21-4	97,99	-0,873	198,173	-0,116	5	4	0	-0,6215	0,6586809
	76836-17-4	20,23	-6,865	428,742	7,9258	1	1	1	0,18998	0,1961344
	7683-64-9	0	-6,3	410,727	13,099	0	0	1	-3,5218	0,1362489
	76844-25-2	13,14	-3,777	216,323	4,2567	1	0	0	-1,1257	0,4553543
	76844-26-3	13,14	-3,741	216,323	4,2807	1	0	0	-3,8693	0,3733813
	76862-65-2	722,15	-3,46	1437,63	-11,325	38	21	3	3,7415	0,450591
	76868-97-8	52,6	-1,912	208,212	0,8743	4	0	0	-7,9682	0,3060965
	76898-48-1	20,23	-6,601	426,726	7,8213	1	1	1	0,5943	0,216346
	76901-59-2	405,61	-1,652	891,934	-8,6005	25	13	3	-0,026754	0,3702858
	76907-63-6	20,23	-6,348	400,688	7,5606	1	1	1	-12,557	0,1427677
	76907-64-7	20,23	-6,348	400,688	7,5606	1	1	1	-12,557	0,1427677
	76907-70-5	110,13	-5,736	532,715	4,995	7	2	1	2,5569	0,096778
	76915-24-7	60,44	-5,44	462,628	6,4836	4	0	1	-1,5099	0,1959959
	7694-45-3	37,3	-2,014	166,219	2,0851	2	1	0	-21,468	0,2827108
	76958-67-3	125,82	-2,526	378,376	0,5683	8	3	0	-0,20203	0,3763716