	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	551938-79-5	72,83	-3,258	348,437	2,5814	5	1	0	0,70089	0,4132683
	551938-80-8	72,83	-3,558	350,453	2,515	5	1	0	1,2351	0,7166598
	551938-81-9	93,06	-3,108	366,452	1,6916	6	2	0	1,7085	0,7765741
	55194-68-8	0	-4,384	212,419	6,6483	0	0	1	-18,922	0,2357458
	55221-38-0	55,76	-1,921	216,276	0,9067	4	1	0	-7,4847	0,477464
	55221-40-4	55,76	-1,921	216,276	0,9067	4	1	0	-7,4847	0,477464
	552323-74-7	55,76	-4,366	338,486	5,6993	4	1	1	-4,2255	0,1570069
	552334-12-0	55,76	-4,76	366,54	6,7601	4	1	1	-2,3533	0,0854804
	552-37-4	63,32	-1,705	137,138	0,4674	3	2	0	-1,5411	0,1233269
	55254-51-8	80,92	-0,472	170,163	-0,2691	4	4	0	-1,6256	0,5722099
	552-62-5	76,02	-1,53	166,14	-0,7896	6	2	0	4,8609	0,9708754
	552839-80-2	80,92	-5,643	464,728	5,1754	4	4	1	-3,3179	0,1219142
	552846-51-2	47,02	-6,277	303,34	3,3904	4	1	0	-3,0327	0,2793789
	552846-52-3	56,33	-4,473	290,321	2,2961	4	2	0	2,3968	0,727694
	552866-14-5	141,54	0,966	241,219	-5,5895	8	4	0	1,1568	0,8603848
	55303-97-4	20,23	-4,44	333,696	4,3775	1	1	0	-8,3434	0,1524247
	55303-98-5	40,46	-4,209	314,467	5,0983	2	2	1	-3,4769	0,3050429
	55303-99-6	34,14	-4,074	312,451	4,3496	2	0	0	-1,2467	0,3313238
	55304-01-3	45,29	-5,169	444,59	3,5277	3	1	0	-8,0606	0,0474212
	55306-12-2	9,23	-5,404	410,576	5,1283	1	0	1	-8,5312	0,0290647