Existing Molecules

Selected Molecules (1-100 of 250,886)

Molid  Formula  Iupac  Atoms  Charge  Curation  Details  Save 
10 CH4S METHANETHIOL 6 0 ATB ΔGHyd
12 C3H8S methylsulfanylethane 12 0 ATB ΔGHyd
13 C4H6N2 - 12 0 ATB
16 C4H11N3 2-propylguanidine 18 0 ATB
27 C5H9O10P2 - 26 -3 ATB
34 C14H14FN3O2S 5-(4-fluorophenyl)-N ... 35 0 ATB
37 C5H11NO3S - 21 0 ATB
38 C8H16N2O3S - 30 0 ATB
49 C10H12N5O11P2 - 40 -3 ATB
51 C10H12N5O13P3 - 43 -4 ATB
64 C11H10NO3 - 25 -1 ATB
76 C10H12N5O14P3 - 44 -4 ATB
87 C10H12N5O10P2 - 39 -3 ATB
91 C9H4Cl2N - 16 1 ATB
92 C9H10Cl2N - 22 1 ATB
98 C7H12NO2 - 22 -1 ATB
100 C5H9O13P3 - 30 -4 ATB
102 C2H6O10P3 - 21 -3 ATB
103 C9H11N5O3 (2R,3R,4R)-2-(6-amin ... 28 0 ATB
104 C9H11N5O4 - 29 0 ATB
121 C5H4BrN5 - 15 0 ATB
123 C6H12N2O Piperidine-4-carboxa ... 21 0 ATB ΔGHyd
126 C4H2Br2N2O3 5,5-dibromo-1,3-diaz ... 13 0 ATB
128 C9H13N2O2S - 27 1 ATB
139 C4H5N3 - 12 0 ATB
140 C4H6N4 - 14 0 ATB
146 C8H8N2 - 18 0 ATB
161 C5H4N4S - 14 0 ATB
163 None - 13 0 Manual*
164 None - 27 1 Manual*
165 None - 26 0 Manual*
166 None - 17 0 Manual*
167 None - 14 -1 Manual*
168 None - 15 0 Manual*
169 None - 13 0 Manual*
170 None - 14 0 Manual*
171 None - 14 0 Manual*
172 None - 14 0 Manual*
173 None - 20 0 Manual*
174 None - 19 -1 Manual*
175 None - 19 0 Manual*
176 None - 20 0 Manual*
177 None - 20 0 Manual*
178 None - 21 1 Manual*
179 C5H5N5 - 15 0 ATB
181 C5H5NO - 12 0 ATB
182 C4H5N3 - 12 0 ATB
186 C7H5ClN2 - 15 0 ATB
188 C7H9N2 - 18 1 ATB
193 C6H14NO - 22 1 ATB
194 C6H16N2 - 24 2 ATB
195 C5H12NO - 19 1 ATB
197 C7H14NO2 - 24 1 ATB
199 C3H7NO2S - 14 0 ATB
203 None - 22 0 Manual*
204 None - 22 0 Manual*
205 None - 24 0 Manual*
206 None - 25 1 Manual*
207 None - 20 0 Manual*
208 None - 23 0 Manual*
209 C6H13N2O - 22 1 ATB
210 None - 17 0 Manual*
211 None - 14 0 Manual*
212 None - 17 0 Manual*
213 None - 27 0 Manual*
214 None - 24 0 Manual*
215 None - 19 0 Manual*
216 None - 13 0 Manual*
217 C8H10O2 (2-methoxyphenyl)met ... 20 0 ATB
219 C7H7FO2 4-Fluoro-2-methoxyph ... 17 0 ATB
220 C6H9NS - 17 0 ATB
222 C10H8ClNO 1-(6-chloroindol-1-y ... 21 0 ATB
225 C3H4N2S - 10 0 ATB
228 C6H8O2 cyclohexane-1,4-dion ... 16 0 ATB
231 C6H12O2 (1R,2R)-cyclohexane- ... 20 0 ATB
232 C3H3BrN2 - 9 0 ATB
234 C8H7FO 1-(2-fluorophenyl)et ... 17 0 ATB
236 C8H7FO 1-(3-fluorophenyl)et ... 17 0 ATB
240 C6H12N2O piperidine-1-carboxa ... 21 0 ATB
243 C9H6ClN - 17 0 ATB
249 C9H7NO - 18 0 ATB
253 C9H11NO2 - 23 0 ATB
255 C10H12BrN5O5 - 33 0 ATB
261 C6H5N3 - 14 0 ATB
279 C5H5NO - 12 0 ATB
282 C6H9N2 - 17 1 ATB
287 C6H9N2 - 17 1 ATB
292 C5H5NO2 - 13 0 ATB
293 C5H5NO2 - 13 0 ATB
294 C5H7N3 - 15 0 ATB
295 C4H6N4 - 14 0 ATB
310 C7H6N2 - 15 0 ATB
311 C8H8N2 - 18 0 ATB
317 C6H6N4 - 16 0 ATB
318 C5H5N5 - 15 0 ATB
321 C5H4ClN5 - 15 0 ATB
338 C9H7NO - 18 0 ATB
342 C10H9NO - 21 0 ATB
347 C9H7NO - 18 0 ATB
352 C5H7NS - 14 0 ATB
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