	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	312624-82-1	89,9	-3,998	456,577	5,0522	6	1	1	-0,94488	0,3351684
	31272-50-1	40,46	-6,536	568,883	12,169	2	2	2	0,35	0,1523721
	312909-19-6	69,67	-4,538	402,529	6,4918	5	0	1	-5,8199	0,1266417
	31298-76-7	71,06	-1,928	290,27	-0,2098	6	0	0	-2,7354	0,4979864
	31302-46-2	60,69	-1,644	174,583	0,9769	3	3	0	-2,0434	0,53779
	313-04-2	20,23	-5,975	384,645	7,3184	1	1	1	-2,8567	0,0987656
	3131-52-0	56,25	-1,549	149,149	1,0076	3	3	0	-0,73083	0,6416863
	313242-60-3	20,23	-3,41	220,355	3,2081	1	1	0	-4,8588	0,4210232
	313242-61-4	20,23	-3,41	220,355	3,2081	1	1	0	-4,8588	0,4210232
	313242-62-5	17,07	-3,558	220,355	3,378	1	0	0	-2,0538	0,4542751
	31342-36-6	115,38	-2,367	323,131	-0,4248	7	3	0	-2,4605	0,0638027
	313503-37-6	57,53	-2,986	316,439	4,063	3	2	0	1,1222	0,4044389
	313510-10-0	46,53	-2,735	248,321	2,1442	3	1	0	-3,4217	0,4670631
	313510-12-2	35,53	-2,863	262,348	2,5721	3	0	0	-6,7225	0,4425429
	31358-73-3	38,33	-3,146	227,262	2,7371	3	1	0	-0,39702	0,3668329
	31385-09-8	54,37	-3,975	294,433	5,4139	3	1	1	-21,312	0,1748926
	313951-44-9	63,32	-4,008	273,375	3,3064	3	2	0	-2,2862	0,4221274
	31396-35-7	38,35	-2,778	110,116	-0,5902	3	0	0	-3,545	0,4857395
	31415-00-6	43,37	-2,863	274,359	4,3419	3	0	0	-0,33117	0,5395916
	314255-80-6	104,06	-3,86	286,238	1,9263	6	3	0	-0,94415	0,2545975