	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	31665-30-2	116,74	-3,584	366,345	1,1709	8	1	0	-5,7894	0,4102561
	31665-32-4	64,99	-4,8	314,336	3,6957	5	1	0	-1,6555	0,382081
	316-66-5	45,69	-6,827	287,402	5,1487	3	1	1	-21,56	0,200674
	31699-37-3	0	-2,502	148,248	4,058	0	0	0	-6,6884	0,2466356
	3170-80-7	0	-3,509	119,378	1,6348	0	0	0	-2,2663	0,0629742
	31753-17-0	83,83	-3,711	366,496	4,2207	5	2	0	-24,801	0,3443526
	31753-19-2	63,6	-3,882	348,481	4,7974	4	1	0	-24,874	0,3161373
	3180-30-1	116,17	-0,972	242,186	-2,0407	8	3	0	-0,8328	0,40419
	318294-27-8	54,37	-5,807	416,643	5,8702	3	1	1	-1,7099	0,1268755
	3183-08-2	151,94	-0,435	208,237	-6,3132	6	4	0	-6,2848	0,4910513
	3184-13-2	89,34	-0,515	132,162	-5,1336	4	3	0	-14,031	0,4942292
	31893-35-3	20,23	-6,793	428,742	8,2954	1	1	1	-4,1657	0,1277949
	31894-69-6	60,69	-6,011	584,882	11,906	3	3	2	0,28515	0,1575197
	31930-34-4	26,3	-1,646	179,013	1,0583	2	0	0	-9,037	0,481872
	31930-36-6	26,3	-1,227	226,009	1,3107	2	0	0	-6,528	0,4802691
	31951-75-4	32,86	-2,971	185,225	2,191	2	1	0	-1,885	0,1843521
	3198-29-6	74,6	-1,642	166,132	0,6298	4	2	0	-1,8442	0,1584776
	31999-89-0	103,79	-0,697	141,215	-2,0802	3	2	0	-3,0725	0,5149739
	32013-73-3	124,29	-2,447	280,231	0,5901	7	4	0	-0,032439	0,4144956
	32013-74-4	270,58	-2,872	502,339	-0,3105	14	10	3	1,4121	0,6359799