	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	121727-27-3	171,21	-5,119	411,369	-1,4575	10	6	1	-9,3657	0,3201833
	121769-81-1	134,66	-4,301	540,991	1,9973	10	1	1	-1,4094	0,0435374
	121769-82-2	137,96	-3,929	540,991	1,7874	10	1	1	-1,4235	0,0456587
	121798-80-9	125,43	-4,308	524,992	2,865	9	1	1	-0,40133	0,0510663
	121798-81-0	151,73	-4,053	550,599	2,332	11	1	2	-0,36095	0,3970902
	121819-68-9	118,28	-3,9	463,493	2,0564	10	2	0	3,3601	0,6744044
	121819-69-0	100,26	-3,175	447,494	2,251	9	1	0	3,2152	0,731382
	121819-70-3	109,05	-2,937	419,44	1,614	9	2	0	4,4539	0,7957074
	121819-71-4	108,91	-4,533	433,467	2,2693	9	2	0	3,5912	0,6523163
	121825-42-1	141,87	-4,619	584,66	2,6022	10	1	1	-8,0958	0,1450778
	121825-44-3	141,87	-4,453	558,622	1,7936	10	1	1	-4,5602	0,161545
	121839-27-8	57,53	-1,276	170,207	1,2145	3	2	0	-2,0515	0,2588047
	121849-79-4	69,02	-2,43	367,448	3,034	6	2	0	2,6783	0,8019751
	121877-90-5	26,3	-12,657	705,288	20,293	2	0	2	-28,632	0,0674356
	121877-92-7	26,3	-12,927	719,315	20,747	2	0	2	-28,632	0,0667191
	121878-04-4	26,3	-13,467	747,369	21,656	2	0	2	-28,632	0,0655683
	121923-95-3	38,83	-3,954	290,401	4,0784	3	0	0	-16,201	0,3591401
	121923-96-4	38,83	-4,182	292,417	4,3306	3	0	0	-16,201	0,3383025
	121923-97-5	40,46	-3,869	306,488	4,8538	2	2	0	-1,3586	0,2328501
	121923-98-6	20,23	-4,268	290,489	5,7059	1	1	1	-2,0041	0,1800227