	CAS number	Polar Surface Area	calculated LogS	Molweight	calculated LogP	H-Acceptors	H-Donors	Ro5 violations	Druglikeness	DrugScore
	3687-48-7	20,23	-2,144	128,214	2,4963	1	1	0	-14,808	0,4653502
	368867-33-8	20,23	-4,072	288,473	6,2166	1	1	1	-4,0507	0,2583191
	368879-49-6	289,82	-2,523	755,823	-4,1374	18	10	3	-4,1906	0,254705
	36904-77-5	20,23	-6,135	398,672	7,3195	1	1	1	-1,4772	0,1778296
	36914-79-1	26,3	-3,584	293,942	3,0967	2	0	0	-3,8922	0,1488984
	36916-29-7	104,06	-0,404	216,188	-1,49	6	3	0	1,5071	0,8895689
	369367-31-7	59,67	-4,935	398,541	6,6734	4	1	1	-2,0405	0,2167703
	369367-32-8	59,67	-4,935	398,541	6,6734	4	1	1	-2,0405	0,2167703
	369367-33-9	72,81	-5,682	410,508	5,8469	5	1	1	-2,9257	0,1990846
	369367-34-0	72,81	-5,682	410,508	5,8469	5	1	1	-2,9257	0,1990846
	369368-10-5	51,21	-3,82	342,477	5,8369	3	0	1	-4,1765	0,2179981
	369368-13-8	51,21	-3,82	342,477	5,8369	3	0	1	-4,9875	0,2162063
	369368-16-1	57,53	-4,175	344,493	6,4893	3	2	1	-3,7827	0,1148683
	369368-17-2	57,53	-4,175	344,493	6,4893	3	2	1	-5,965	0,1126553
	369368-20-7	63,6	-4,771	386,53	6,8217	4	1	1	-5,6978	0,1997754
	369380-51-8	17,07	-3,277	218,339	3,2727	1	0	0	-6,488	0,4208574
	369380-52-9	46,53	-4,791	342,477	5,8392	3	1	1	-2,1836	0,2598602
	369380-53-0	60,69	-4,124	346,509	6,5205	3	3	1	-1,9754	0,1261617
	369383-48-2	59,67	-4,899	398,541	7,0615	4	1	1	-1,1369	0,2336005
	36948-66-0	103,2	-6,714	486,779	8,9892	4	0	1	-16,007	0,112928