| Molid > | Formula | Iupac | Atoms | Charge | Curation | Details | Save |
|---|---|---|---|---|---|---|---|
| 8 | C4H10 | 2-Methylpropane | 14 | 0 | ATB | ΔGHyd | |
| 10 | CH4S | METHANETHIOL | 6 | 0 | ATB | ΔGHyd | |
| 12 | C3H8S | methylsulfanylethane | 12 | 0 | ATB | ΔGHyd | |
| 13 | C4H6N2 | - | 12 | 0 | ATB | ||
| 14 | C9H9N | 3-Methyl-1H-indole | 19 | 0 | ATB | ΔGHyd | |
| 15 | C4H11N | butan-1-amine | 16 | 0 | ATB | ΔGHyd | |
| 16 | C4H11N3 | 2-propylguanidine | 18 | 0 | ATB | ||
| 17 | C7H8O | 4-Methylphenol | 16 | 0 | ATB | ΔGHyd | |
| 18 | C3H8 | PROPANE | 11 | 0 | ATB | ΔGHyd | |
| 19 | C3H7NO | Propanamide | 12 | 0 | ATB | ΔGHyd | |
| 20 | C3H6O2 | Propanoic acid | 11 | 0 | ATB | ΔGHyd | |
| 21 | C7H8 | methylbenzene | 15 | 0 | ATB | ΔGHyd | |
| 22 | C2H4O2 | acetic acid | 8 | 0 | ATB | ΔGHyd | |
| 27 | C5H9O10P2 | - | 26 | -3 | ATB | ||
| 33 | C2H5NO | ACETAMIDE | 9 | 0 | ATB | ΔGHyd | |
| 34 | C14H14FN3O2S | 5-(4-fluorophenyl)-N ... | 35 | 0 | ATB | ||
| 37 | C5H11NO3S | - | 21 | 0 | ATB | ||
| 38 | C8H16N2O3S | - | 30 | 0 | ATB | ||
| 43 | O2 | Molecular oxygen | 2 | 0 | ATB | ||
| 49 | C10H12N5O11P2 | - | 40 | -3 | ATB | ||
| 51 | C10H12N5O13P3 | - | 43 | -4 | ATB | ||
| 58 | C27H38N2O4 | (2R)-2-(3,4-dimethox ... | 71 | 0 | ATB | ||
| 63 | C8H10O | 2-PHENYLETHANOL | 19 | 0 | ATB | ΔGHyd | |
| 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 | ||
| 113 | C3H8O | Propan-2-ol | 12 | 0 | ATB | ΔGHyd | |
| 118 | C10H12BrN5O4 | (2R,3R,4S,5R)-2-(6-a ... | 32 | 0 | ATB | ||
| 121 | C5H4BrN5 | - | 15 | 0 | ATB | ||
| 122 | C6H11NO2 | Piperidine-4-carboxy ... | 20 | 0 | ATB | ||
| 123 | C6H12N2O | Piperidine-4-carboxa ... | 21 | 0 | ATB | ΔGHyd | |
| 125 | C4H3BrN2O2 | 5-bromo-1H-pyrimidin ... | 12 | 0 | ATB | ΔGHyd | |
| 126 | C4H2Br2N2O3 | 5,5-dibromo-1,3-diaz ... | 13 | 0 | ATB | ||
| 127 | C7H4ClNOS | 5-chloro-3H-1,3-benz ... | 15 | 0 | ATB | ||
| 128 | C9H13N2O2S | - | 27 | 1 | ATB | ||
| 139 | C4H5N3 | - | 12 | 0 | ATB | ||
| 140 | C4H6N4 | - | 14 | 0 | ATB | ||
| 144 | C7H9N | 3-Methylaniline | 17 | 0 | ATB | ||
| 146 | C8H8N2 | - | 18 | 0 | ATB | ||
| 152 | C6H6O2 | benzene-1,3-diol | 14 | 0 | ATB | ||
| 153 | C7H9N | 4-Methylaniline | 17 | 0 | ATB | ΔGHyd | |
| 158 | C8H9N3 | - | 20 | 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 | ||
| 183 | C7H7N3 | 1H-Indazol-6-amine | 17 | 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 | ||
| 218 | C9H6ClNO | - | 18 | 0 | ATB | ||
| 219 | C7H7FO2 | 4-Fluoro-2-methoxyph ... | 17 | 0 | ATB | ||
| 220 | C6H9NS | - | 17 | 0 | ATB | ||
| 221 | C5H6N2O2 | 5-methyl-1H-pyrimidi ... | 15 | 0 | ATB | ||
| 222 | C10H8ClNO | 1-(6-chloroindol-1-y ... | 21 | 0 | ATB | ||
| 224 | C8H6ClNO | 6-chloro-1,3-dihydro ... | 17 | 0 | ATB | ||
| 225 | C3H4N2S | - | 10 | 0 | ATB | ||
| 226 | C9H6O2 | chromen-4-one | 17 | 0 | ATB |
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