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Compound Details | |||||
S.No. | Molceule ID (DB) | Molecule_name | POLAR SURFACE AREA 2D(+/- 5) | ||
1 | EGIN0000003 | LAPATINIB | 114.73 | ||
2 | EGIN0000039 | 28 | 113.6 | ||
3 | EGIN0000181 | 20 | 109.79 | ||
4 | EGIN0000194 | 14f | 113.41 | ||
5 | EGIN0000368 | 1h | 113.09 | ||
6 | EGIN0000370 | 1j | 113.09 | ||
7 | EGIN0000551 | 23 | 107.6 | ||
8 | EGIN0000552 | 24 | 107.6 | ||
9 | EGIN0000553 | 25 | 116.83 | ||
10 | EGIN0000554 | 26 | 107.6 | ||
11 | EGIN0000555 | 27 | 116.83 | ||
12 | EGIN0000556 | 28 | 107.6 | ||
13 | EGIN0000577 | 6a | 114.73 | ||
14 | EGIN0000578 | 6c | 114.48 | ||
15 | EGIN0000636 | gw9263 | 110.05 | ||
16 | EGIN0000637 | gw4263 | 112.59 | ||
17 | EGIN0000639 | gw5289 | 112.61 | ||
18 | EGIN0000648 | GW2016 | 114.73 | ||
19 | EGIN0000751 | 48 | 109.65 | ||
20 | EGIN0000793 | 8r | 108.4 | ||
21 | EGIN0000807 | NERATINIB | 112.4 | ||
22 | EGIN0000855 | 18 | 112.99 | ||
23 | EGIN0000860 | 23 | 110.26 | ||
24 | EGIN0000915 | 26 | 112.14 | ||
25 | EGIN0000916 | 27 | 112.14 | ||
26 | EGIN0000923 | 34 | 113.45 | ||
27 | EGIN0001020 | 1g | 117.01 | ||
28 | EGIN0001022 | 1i | 117.01 | ||
29 | EGIN0001102 | 18 | 110.14 | ||
30 | EGIN0001106 | 22 | 110.25 | ||
31 | EGIN0001111 | 26 | 109.81 | ||
32 | EGIN0001116 | 31 | 114.24 | ||
33 | EGIN0001121 | 36 | 112.47 | ||
34 | EGIN0001122 | 37 | 112.47 | ||
35 | EGIN0001132 | 37 | 111.66 | ||
36 | EGIN0001217 | 5 | 117.51 | ||
37 | EGIN0001218 | 6 | 117.51 | ||
38 | EGIN0001219 | 7 | 117.51 | ||
39 | EGIN0001242 | AG933 | 113.58 | ||
40 | EGIN0001244 | AG529 | 111.81 | ||
41 | EGIN0001289 | 7 | 110.36 | ||
42 | EGIN0001291 | 8a | 111.83 | ||
43 | EGIN0001294 | 8d | 114.63 | ||
44 | EGIN0001295 | 8e | 111.39 | ||
45 | EGIN0001296 | 8f | 111.39 | ||
46 | EGIN0001299 | 8i | 111.39 | ||
47 | EGIN0001359 | 1m | 112.61 | ||
48 | EGIN0001400 | 9b | 116.19 | ||
49 | EGIN0001410 | 15j | 116.85 | ||
50 | EGIN0001426 | 20 | 108.65 | ||
51 | EGIN0001459 | 16 | 112.36 | ||
52 | EGIN0001481 | 3 | 114.69 | ||
53 | EGIN0001505 | 7a | 109.87 | ||
54 | EGIN0001573 | 46 | 110.81 | ||
55 | EGIN0001583 | 6d | 116.85 | ||
56 | EGIN0001584 | 6e | 116.85 | ||
57 | EGIN0001585 | 6f | 116.85 | ||
58 | EGIN0001586 | 6g | 116.85 | ||
59 | EGIN0001594 | 15 | 116.85 | ||
60 | EGIN0001621 | 15d | 113.61 | ||
61 | EGIN0001660 | 5 | 113.98 | ||
62 | EGIN0001662 | 7 | 111.86 | ||
63 | EGIN0001665 | 10 | 113.63 | ||
64 | EGIN0001673 | 20 | 113.63 | ||
65 | EGIN0001675 | 19 | 113.63 | ||
66 | EGIN0001679 | 25 | 108.27 | ||
67 | EGIN0001696 | 41 | 113.98 | ||
68 | EGIN0001727 | Camptothecin | 110.96 | ||
69 | EGIN0001747 | 8 | 114.92 | ||
70 | EGIN0001868 | 8 | 115.58 | ||
71 | EGIN0001907 | 33 | 108.87 | ||
72 | EGIN0001908 | 34 | 108.87 | ||
73 | EGIN0001964 | 5a | 109.7 | ||
74 | EGIN0001965 | 5b | 109.7 | ||
75 | EGIN0001966 | 8a | 109.7 | ||
76 | EGIN0001967 | 8b | 109.7 | ||
77 | EGIN0001968 | 8c | 109.7 | ||
78 | EGIN0001969 | 11a | 109.7 | ||
79 | EGIN0001970 | 11b | 109.7 | ||
80 | EGIN0001976 | 12a | 108.42 | ||
81 | EGIN0001979 | 12d | 108.42 | ||
82 | EGIN0001985 | 12j | 109.87 | ||
83 | EGIN0001989 | 12n | 113.11 | ||
84 | EGIN0001990 | 12o | 110.31 | ||
85 | EGIN0001991 | 12p | 110.31 | ||
86 | EGIN0001992 | 12q | 110.31 | ||
87 | EGIN0001994 | 16a | 110.31 | ||
88 | EGIN0002063 | PP20 | 117.18 | ||
89 | EGIN0002068 | PP139 | 108.29 | ||
90 | EGIN0002075 | PP30 | 111.08 | ||
91 | EGIN0002083 | PP38 | 115.79 | ||
92 | EGIN0002089 | PP44 | 108.54 | ||
93 | EGIN0002127 | PP146 | 108.53 | ||
94 | EGIN0002128 | PP147 | 108.53 | ||
95 | EGIN0002130 | PP149 | 109.58 | ||
96 | EGIN0002135 | PP155 | 113.64 | ||
97 | EGIN0002136 | PP156 | 110.75 | ||
98 | EGIN0002137 | PP157 | 113.64 | ||
99 | EGIN0002138 | PP158 | 111.08 | ||
100 | EGIN0002145 | PP203 | 115.87 | ||
101 | EGIN0002151 | PP281 | 115.87 | ||
102 | EGIN0002152 | PP306 | 108.31 | ||
103 | EGIN0002153 | PP32 | 112.71 | ||
104 | EGIN0002155 | PP321 | 109.94 | ||
105 | EGIN0002174 | PP40 | 115.79 | ||
106 | EGIN0002175 | PP401 | 115.88 | ||
107 | EGIN0002178 | PP407 | 111.11 | ||
108 | EGIN0002181 | PP411 | 111.11 | ||
109 | EGIN0002187 | PP450 | 115.87 | ||
110 | EGIN0002188 | PP452 | 115.87 | ||
111 | EGIN0002189 | PP454 | 115.87 | ||
112 | EGIN0002190 | PP456 | 115.87 | ||
113 | EGIN0002194 | PP469 | 113.64 | ||
114 | EGIN0002195 | PP471 | 113.64 | ||
115 | EGIN0002202 | PP495 | 108.31 | ||
116 | EGIN0002203 | PP496 | 108.31 | ||
117 | EGIN0002215 | PP66 | 113.86 | ||
118 | EGIN0002261 | 30 | 109.87 | ||
119 | EGIN0002263 | 32 | 109.87 | ||
120 | EGIN0002349 | 7e | 117.29 | ||
121 | EGIN0002390 | 19 | 108.71 | ||
122 | EGIN0002449 | 1 | 114.16 | ||
123 | EGIN0002451 | 9a | 114.16 | ||
124 | EGIN0002454 | 9d | 114.16 | ||
125 | EGIN0002455 | 9e | 114.16 | ||
126 | EGIN0002456 | 9f | 114.16 | ||
127 | EGIN0002457 | 9g | 114.16 | ||
128 | EGIN0002458 | 9h | 114.16 | ||
129 | EGIN0002459 | 11 | 114.16 | ||
130 | EGIN0002461 | 13 | 114.16 | ||
131 | EGIN0002462 | 14 | 114.16 | ||
132 | EGIN0002466 | 21 | 114.16 | ||
133 | EGIN0002467 | 22 | 114.16 | ||
134 | EGIN0002469 | 24 | 114.16 | ||
135 | EGIN0002470 | 25 | 114.16 | ||
136 | EGIN0002471 | 26 | 114.16 | ||
137 | EGIN0002472 | 27 | 114.16 | ||
138 | EGIN0002473 | 28 | 114.16 | ||
139 | EGIN0002508 | 6a | 109.51 | ||
140 | EGIN0002512 | 7a | 115.3 | ||
141 | EGIN0002514 | 7c | 115.3 | ||
142 | EGIN0002518 | 8a | 109.51 | ||
143 | EGIN0002561 | 10 | 115.49 | ||
144 | EGIN0002582 | 5 | 110.35 | ||
145 | EGIN0002594 | 17 | 110.02 | ||
146 | EGIN0002635 | Butyrolactone | 113.29 | ||
147 | EGIN0002651 | 10g | 108.24 | ||
148 | EGIN0002786 | 2 | 115.09 | ||
149 | EGIN0002791 | AG370 | 113.18 | ||
150 | EGIN0002800 | 16 | 117.14 | ||
151 | EGIN0002826 | 62 | 111.81 | ||
152 | EGIN0002845 | 10l | 108.52 | ||
153 | EGIN0002871 | I1 | 110.35 | ||
154 | EGIN0002874 | I4 | 111.38 | ||
155 | EGIN0002875 | I5 | 111.38 | ||
156 | EGIN0002876 | I6 | 108.58 | ||
157 | EGIN0002877 | I9 | 111.38 | ||
158 | EGIN0002878 | I10 | 111.38 | ||
159 | EGIN0002879 | I11 | 111.38 | ||
160 | EGIN0002888 | II1 | 110.02 | ||
161 | EGIN0002891 | II4 | 111.05 | ||
162 | EGIN0002892 | II5 | 111.05 | ||
163 | EGIN0002893 | II6 | 108.25 | ||
164 | EGIN0002896 | II9 | 111.05 | ||
165 | EGIN0002897 | II10 | 111.05 | ||
166 | EGIN0002898 | II11 | 111.05 | ||
167 | EGIN0002930 | 7 | 110.69 | ||
168 | EGIN0003012 | 26c | 115.04 | ||
169 | EGIN0003019 | 26j | 115.48 | ||
170 | EGIN0003020 | 26k | 112.24 | ||
171 | EGIN0003025 | 26p | 115.04 | ||
172 | EGIN0003026 | 26q | 115.04 | ||
173 | EGIN0003029 | 26t | 115.04 | ||
174 | EGIN0003030 | 28a | 112.24 | ||
175 | EGIN0003031 | 28b | 117.17 | ||
176 | EGIN0003042 | 43 | 115.86 | ||
177 | EGIN0003109 | 24 | 110.28 | ||
178 | EGIN0003146 | 31a | 111.43 | ||
179 | EGIN0003157 | 5 | 111.15 | ||
180 | EGIN0003213 | 14b | 111.12 | ||
181 | EGIN0003214 | 17 | 117.55 | ||
182 | EGIN0003233 | 4o | 112.29 | ||
183 | EGIN0003239 | 5f | 112.29 | ||
184 | EGIN0003261 | 1s | 115.29 | ||
185 | EGIN0003264 | 10 | 116.44 | ||
186 | EGIN0003307 | 7a | 108.1 | ||
187 | EGIN0003308 | 7b | 112.4 | ||
188 | EGIN0003309 | 7c | 108.1 | ||
189 | EGIN0003311 | 7e | 108.1 | ||
190 | EGIN0003314 | 8c | 116.06 | ||
191 | EGIN0003318 | 21a | 117.33 | ||
192 | EGIN0003322 | 8h | 108.1 | ||
193 | EGIN0003330 | 8m | 108.74 | ||
194 | EGIN0003331 | 8n | 108.74 | ||
195 | EGIN0003352 | 25p | 112.4 | ||
196 | EGIN0003353 | 25q | 112.65 | ||
197 | EGIN0003354 | 25r | 112.4 | ||
198 | EGIN0003355 | 25s | 112.4 | ||
199 | EGIN0003363 | 37 | 115.2 | ||
200 | EGIN0003364 | 38 | 114.34 | ||
201 | EGIN0003365 | 7g | 108.74 | ||
202 | EGIN0003370 | 7l | 108.74 | ||
203 | EGIN0003375 | 7q | 108.74 | ||
204 | EGIN0003383 | 75 | 109.16 | ||
205 | EGIN0003385 | 77 | 114.09 | ||
206 | EGIN0003386 | 82 | 113.34 | ||
207 | EGIN0003388 | 84 | 108.74 | ||
208 | EGIN0003389 | 85 | 116.5 | ||
209 | EGIN0003391 | 5 | 107.88 | ||
210 | EGIN0003437 | 63 | 108.4 | ||
211 | EGIN0003488 | 12 | 109.82 | ||
212 | EGIN0003489 | BMS-645737 | 109.82 | ||
213 | EGIN0003599 | 16 | 116.85 | ||
214 | EGIN0003610 | 27 | 112.31 | ||
215 | EGIN0003876 | AG825 | 109.23 | ||
216 | EGIN0003970 | 6 | 115.82 | ||
217 | EGIN0003988 | 2p | 112.25 | ||
218 | EGIN0003991 | 3c | 112.25 | ||
219 | EGIN0004109 | 18 | 109.73 | ||
220 | EGIN0004115 | 13 | 108.77 | ||
221 | EGIN0004124 | 15 | 115.06 | ||
222 | EGIN0004140 | ISOHEMATOXYLIN | 110.38 | ||
223 | EGIN0004148 | HEMATOXYLIN | 110.38 | ||
224 | EGIN0004185 | 2 | 108.5 | ||
225 | EGIN0004190 | 7 | 117.29 | ||
226 | EGIN0004191 | 8 | 117.29 | ||
227 | EGIN0004192 | 9 | 117.29 | ||
228 | EGIN0004193 | 10 | 117.29 | ||
229 | EGIN0004232 | 3ee | 117.1 | ||
230 | EGIN0004260 | 13a | 109.34 | ||
231 | EGIN0004261 | 13b | 109.34 | ||
232 | EGIN0004262 | 13c | 109.34 | ||
233 | EGIN0004263 | 13d | 109.34 | ||
234 | EGIN0004264 | 13e | 109.34 | ||
235 | EGIN0004265 | 13f | 109.34 | ||
236 | EGIN0004266 | 13g | 109.34 | ||
237 | EGIN0004267 | 13h | 109.34 | ||
238 | EGIN0004292 | 10 | 114.83 | ||
239 | EGIN0004294 | 12 | 114.83 | ||
240 | EGIN0004330 | 12 | 110.77 | ||
241 | EGIN0004331 | 13 | 110.77 | ||
242 | EGIN0004345 | 49 | 114.43 | ||
243 | EGIN0004436 | 6g | 108.5 | ||
244 | EGIN0004498 | 47m | 114.19 | ||
245 | EGIN0004499 | 46m | 114.19 | ||
246 | EGIN0004519 | 3n | 108.48 | ||
247 | EGIN0004521 | 3l | 108.92 | ||
248 | EGIN0004530 | 3d | 108.84 | ||
249 | EGIN0004542 | 2x | 115.4 | ||
250 | EGIN0004544 | 2v | 115.4 | ||
251 | EGIN0004545 | 2u | 115.4 | ||
252 | EGIN0004566 | 2d | 112.16 | ||
253 | EGIN0004581 | 1e | 111.3 | ||
254 | EGIN0004583 | 1d | 110.35 | ||
255 | EGIN0004641 | 10d | 115.06 | ||
256 | EGIN0004643 | 10c | 115.06 | ||
257 | EGIN0004649 | 44 | 112.73 | ||
258 | EGIN0004650 | 43 | 112.73 | ||
259 | EGIN0004651 | 42 | 112.73 | ||
260 | EGIN0004652 | 41 | 112.73 | ||
261 | EGIN0004669 | 31 | 112.73 | ||
262 | EGIN0004671 | 30 | 112.73 | ||
263 | EGIN0004723 | 20 | 112.4 | ||
264 | EGIN0004730 | 19 | 112.4 | ||
265 | EGIN0004737 | 18 | 109.16 | ||
266 | EGIN0004752 | 16 | 116.12 | ||
267 | EGIN0004756 | 15 | 114.01 | ||
268 | EGIN0004817 | 9 | 112.31 | ||
269 | EGIN0004819 | 8 | 113.18 | ||
270 | EGIN0004821 | 8 | 110.77 | ||
271 | EGIN0004829 | 7 | 110.77 | ||
272 | EGIN0004839 | 6 | 110.77 | ||
273 | EGIN0004845 | 6 | 115.38 | ||
274 | EGIN0004914 | 5u | 111.17 | ||
275 | EGIN0004915 | 5w | 111.17 | ||
276 | EGIN0005020 | 1a | 115.21 | ||
277 | EGIN0005021 | 1d | 115.21 | ||
278 | EGIN0005022 | 1e | 115.21 | ||
279 | EGIN0005023 | 1f | 115.21 | ||
280 | EGIN0005025 | 1b | 115.21 | ||
281 | EGIN0005026 | 1c | 115.21 | ||
282 | EGIN0005027 | 2a | 115.21 | ||
283 | EGIN0005028 | 2b | 115.21 | ||
284 | EGIN0005029 | 2c | 115.21 | ||
285 | EGIN0005150 | 8h | 109.87 | ||
286 | EGIN0005152 | 8j | 115.86 | ||
287 | EGIN0005158 | 8p | 108.84 | ||
288 | EGIN0005167 | 8y | 108.84 | ||
289 | EGIN0005168 | 8z | 112.08 | ||
290 | EGIN0005180 | 2f | 108.81 | ||
291 | EGIN0005181 | 3a | 108.81 | ||
292 | EGIN0005182 | 3b | 108.81 | ||
293 | EGIN0005184 | 3f | 112.05 | ||
294 | EGIN0005185 | 3g | 112.05 | ||
295 | EGIN0005191 | 3n | 112.05 | ||
296 | EGIN0005192 | 3o | 112.05 | ||
297 | EGIN0005200 | 3w | 115.29 | ||
298 | EGIN0005201 | 3x | 115.29 | ||
299 | EGIN0005202 | 3y | 108.81 | ||
300 | EGIN0005203 | 3z | 108.81 | ||
301 | EGIN0005219 | 12 | 115.72 |