| CID |
miLogP |
TPSA |
natoms |
MW |
nON |
nOHNH |
nviolations |
nrotb |
volume |
| MK-5172 (46930991) |
4.747 |
140.192 |
40 |
554.644 |
11 |
2 |
2 |
3 |
505.606 |
| 59178018 |
4.747 |
140.192 |
40 |
554.644 |
11 |
2 |
2 |
3 |
505.606 |
| 71278306 |
4.747 |
140.192 |
40 |
554.644 |
11 |
2 |
2 |
3 |
505.606 |
| 71307589 |
4.747 |
140.192 |
40 |
554.644 |
11 |
2 |
2 |
3 |
505.606 |
| 67304193 |
5.356 |
140.192 |
41 |
568.671 |
11 |
2 |
3 |
3 |
522.193 |
| 67304412 |
5.456 |
140.192 |
41 |
566.655 |
11 |
2 |
3 |
3 |
516.006 |
| 71276289 |
6.614 |
140.192 |
41 |
570.687 |
11 |
2 |
3 |
14 |
532.983 |
| 68491802 |
4.747 |
140.192 |
40 |
552.628 |
11 |
2 |
2 |
3 |
499.42 |
| 68491803 |
4.747 |
140.192 |
40 |
552.628 |
11 |
2 |
2 |
3 |
499.42 |
| 59178019 |
6.82 |
129.198 |
41 |
568.671 |
11 |
1 |
3 |
4 |
523.134 |
| 67304190 |
6.82 |
129.198 |
41 |
568.671 |
11 |
1 |
3 |
4 |
523.134 |
| 71276290 |
1.259 |
140.192 |
36 |
498.536 |
11 |
2 |
1 |
2 |
439.394 |
| 71278250 |
7.23 |
129.198 |
42 |
584.714 |
11 |
1 |
3 |
15 |
550.511 |
| 72535811 |
6.82 |
129.198 |
41 |
568.671 |
11 |
1 |
3 |
4 |
523.134 |
| 71278254 |
5.452 |
175.731 |
47 |
658.749 |
14 |
2 |
3 |
16 |
602.545 |
| 71278255 |
6.462 |
175.731 |
49 |
686.803 |
14 |
2 |
3 |
18 |
636.149 |
| 71278248 |
5.182 |
158.215 |
42 |
586.686 |
12 |
3 |
3 |
16 |
541.612 |
| 68236439 |
5.044 |
140.192 |
40 |
556.66 |
11 |
2 |
3 |
13 |
516.181 |
| 59178016 |
6.92 |
129.198 |
41 |
566.655 |
11 |
1 |
3 |
4 |
516.947 |
| 67304410 |
6.92 |
129.198 |
41 |
566.655 |
11 |
1 |
3 |
4 |
516.947 |
| 71276250 |
4.672 |
116.889 |
38 |
526.678 |
9 |
2 |
1 |
13 |
504.868 |
| 72535809 |
6.92 |
129.198 |
41 |
566.655 |
11 |
1 |
3 |
4 |
516.947 |
| 59178020 |
7.828 |
129.198 |
43 |
594.709 |
11 |
1 |
3 |
15 |
555.835 |
| 67304070 |
7.828 |
129.198 |
43 |
594.709 |
11 |
1 |
3 |
15 |
555.835 |
| 72535812 |
7.828 |
129.198 |
43 |
594.709 |
11 |
1 |
3 |
15 |
555.835 |
| 71276269 |
6.129 |
140.192 |
41 |
566.655 |
11 |
2 |
3 |
11 |
521.523 |
| 68236192 |
7.117 |
129.198 |
41 |
570.687 |
11 |
1 |
3 |
14 |
533.709 |
| 71529660 |
5.978 |
175.731 |
49 |
682.771 |
14 |
2 |
3 |
15 |
624.689 |
| 71276247 |
4.698 |
158.215 |
42 |
582.654 |
12 |
3 |
2 |
13 |
530.153 |
| 71532366 |
4.698 |
158.215 |
42 |
582.654 |
12 |
3 |
2 |
13 |
530.153 |
| 68236191 |
7.217 |
129.198 |
41 |
568.671 |
11 |
1 |
3 |
13 |
527.522 |
| 58428446 |
3.521 |
128.165 |
40 |
553.656 |
10 |
1 |
1 |
3 |
510.006 |
|
