	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	169529-04-8	49,69	-4,191	344,493	5,1992	3	2	1	-4,6425	0,2889134
	169529-05-9	49,69	-4,59	344,493	5,1688	3	2	1	-4,2141	0,1657177
	169529-96-8	58,92	-2,962	348,481	4,3357	4	2	0	-5,8603	0,3648583
	169547-59-5	54,12	-2,11	232,282	0,9964	4	2	0	0,19174	0,7323213
	169564-96-9	38,69	-6,193	428,654	6,0984	3	1	1	-1,003	0,1247335
	169565-73-5	17,07	-7,65	432,774	12,209	1	0	1	-25,626	0,0676633
	169565-77-9	40,46	-6,027	428,698	6,9627	2	2	1	-11,207	0,1509595
	169565-78-0	29,46	-6,155	442,725	7,3906	2	1	1	-10,552	0,1398494
	169565-87-1	80,92	-5,385	462,712	5,4985	4	4	1	-3,8029	0,1990476
	169565-88-2	80,92	-5,385	462,712	5,4985	4	4	1	-3,8029	0,1990476
	169626-20-4	46,53	-3,452	316,439	4,5516	3	1	0	-1,5994	0,4076459
	169626-35-1	77,56	-3,702	358,4	1,8459	6	2	0	6,1517	0,8060375
	169626-36-2	58,28	-3,649	318,503	4,32	3	3	0	-8,2132	0,3542667
	169738-53-8	111,52	-2,287	434,483	1,1779	8	2	0	-21,149	0,323408
	16978-66-8	83,55	-1,245	181,19	-1,8949	4	3	0	-11,045	0,4887706
	16980-85-1	0	-7,133	350,672	11,243	0	0	1	-27,655	0,0771705
	169869-80-1	49,69	-3,02	318,455	4,4313	3	2	0	-2,817	0,3858064
	169869-81-2	66,76	-3,002	332,438	3,6921	4	2	0	-2,7332	0,4194414
	169869-87-8	77,56	-3,702	358,4	1,8459	6	2	0	6,1517	0,8060375
	169970-79-0	186,12	-6,81	754,995	7,8505	12	4	3	-2,0441	0,052536