	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	12626-17-4	95,24	-2,167	479,575	3,2283	8	2	0	6,965	0,421998
	12626-18-5	102,7	-4,328	579,692	4,7031	10	1	1	0,38757	0,0719816
	126-29-4	65,52	-6,298	600,881	9,8516	4	2	2	1,1925	0,1662187
	126297-39-0	204,52	-4,469	743,951	0,2072	12	3	2	7,9387	0,4262967
	126-33-0	42,52	-1,12	120,172	-0,14	2	0	0	-6,3193	0,4918233
	126-38-5	18,46	-1,337	183,044	1,5001	2	0	0	-19,737	0,138587
	126394-74-9	34,14	-5,978	398,628	6,4469	2	0	1	-6,7359	0,1680235
	126452-98-0	207,99	-4,74	741,935	1,3747	12	3	2	8,8324	0,4061285
	126572-73-4	77,65	-6,777	453,497	4,4859	7	2	0	4,5775	0,3786322
	126576-88-3	17,07	-6,72	412,699	8,2393	1	0	1	-6,9642	0,0281095
	126582-61-4	17,07	-3,9	260,419	4,4058	1	0	0	-5,1886	0,1267513
	126584-09-6	49,41	-3,473	293,369	1,7237	4	2	0	1,6235	0,7888461
	126584-10-9	49,41	-2,338	217,271	0,2818	4	2	0	1,2965	0,8456979
	126596-02-9	127,25	-3,805	550,094	3,5707	9	3	1	3,3143	0,5310932
	126596-03-0	127,25	-3,707	627,514	3,0425	9	3	1	4,4793	0,4902862
	126596-04-1	127,25	-3,525	580,518	3,3306	9	3	1	2,3473	0,5093565
	126596-05-2	127,25	-3,427	536,067	3,2114	9	3	1	4,1932	0,5868712
	126596-06-3	89,21	-3,114	415,484	2,9667	7	1	0	-17,697	0,228889
	126610-17-1	111,66	-3,496	448,51	2,0373	8	1	0	1,8195	0,5443476
	126622-61-5	56,81	-3,926	342,525	3,3406	3	0	0	0,91411	0,3085854