ACD033

167768 distinct SMILES
From thorlist

List  Count  % of Total

16   133201    79.4%
17    19217    11.5%
18     6325     3.8%
19     2669     1.6%
20     1499
21      960
22      630
23      378
24      352
25      308
26      148
27      114
28      157
29      135
30       59
31       36
32       62
33       23
34       56
35       20
36       12
37       48
38       15
39       90
40       43
41        7
42       88
43        6
44        7
45       10
46       47
48       53
49       53
50       56
51        6
52        6
53        4
54       62
55        2
56        7
57        5
58       59
59        6
60       60
62       69
63       65
64        1
65        6
66       54
67        3
68        1
70       76
71        1
72        1
73        4
74        1
75       19
77        1
78       17
81       82
86        6
87        2
88        2
89        6
91        7
95        5
97       10
99       99
101       2
111     111
112      10
120       1
121       1
124       2
125       2

List  Count  % of Total

16   128858    85.9%
17    15511    10.3%
18     3473     2.3%
19     1122
20      454
21      219
22      101
23       78
24       34
25       32
26       22
27       16
28        8
29       10
30        6
31        3
32        1
34        1

63009 distinct SMILES
From thorlist

List  Count  % of Total

16    53833    85.4%
17     5952     9.4%
18     1566     2.5%
19      702     1.1%
20      306
21      187
22      133
23       76
24       60
25       48
26       54
27       21
28       17
29       12
30        5
31        2
32       12
33        6
34        3
35        4
36        4
37        3
38        2
41        1

57870 distinct fingerprints
Duplicate fingerprints removed

List  Count  % of Total

16    53310    92.1%
17     3662     6.3%
18      593     1.0%
19      179
20       46
21       33
22       17
23        5
24        9
25        8
26        5
27        1
28        1
34        1