Microstates

Showing 201 through 300 of 487
Rank Microstate SMILES ΔG / kcal M-1
201 MAT-POS-ec6d90b7-1_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)OC3=O −8.46 ± 0.05
202 EDJ-MED-b6c6ee2b-1_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)OCC[NH+](C)C)Cl −8.5 ± 0.4
203 LUO-POS-b4dec3be-1_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)F)Cl −8.4 ± 0.2
204 EDJ-MED-468565e0-5_2 molecule c1cc2cncc(c2cc1OCCN3CC(C3)(F)F)N4CC[C@@]5(C4=O)C[N@](Cc6c5cc(cc6)Cl)S(=O)(=O)CC7(CC7)C#N −8.4 ± 0.7
205 ALP-POS-ecbed2ba-17_3 molecule C[N@@](CC#N)S(=O)(=O)[N@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −8.4 ± 0.5
206 LUO-POS-ed2cfb03-1_2 molecule C[NH+]1CCN(CC1)S(=O)(=O)[N@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −8.4 ± 0.8
207 EDJ-MED-7e491f08-1_1 molecule c1ccc2c(c1)cncc2N3CC([C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N)(F)F −8.4 ± 0.5
208 MAT-POS-38eb6498-5_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)C(=O)NC)Cl −8.4 ± 0.2
209 LUO-POS-b5068a05-2_2 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N)N=C3NC#N −8.4 ± 0.4
210 EDJ-MED-8bb691af-6_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −8.4 ± 0.3
211 MAT-POS-50a80394-4_4 molecule C[C@H]1CN(C(=O)[C@@]12C[N@H+](Cc3c2cc(cc3)Cl)CC(=O)NC)c4cncc5c4cccc5 −8.4 ± 0.2
212 PET-UNK-7e9559de-1_2 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@H+](Cc5c4cc(cc5)Cl)Cc6nncs6 −8.3 ± 0.2
213 MAT-POS-96396902-1_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@H+](Cc5c4cc(cc5)Cl)Cc6nncs6 −8.3 ± 0.2
214 PET-UNK-94036022-5_1 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)Cl −8.3 ± 0.3
215 MAT-POS-1bed62cf-1_1 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −8.3 ± 0.3
216 EDJ-MED-468565e0-4_1 molecule c1cc2cncc(c2cc1OCC[NH+]3CCC(CC3)(F)F)N4CC[C@@]5(C4=O)C[N@@](Cc6c5cc(cc6)Cl)S(=O)(=O)CC7(CC7)C#N −8.3 ± 0.8
217 MAT-POS-c2d406ed-4_2 molecule CN1C(=S)N(C(=O)[C@@]12C[N@](Cc3c2cc(cc3)Cl)S(=O)(=O)CC4(CC4)C#N)c5cncc6c5cccc6 −8.3 ± 0.5
218 MAT-POS-1d5ab790-2_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4c(ccc5)Cl)Cl −8.3 ± 0.2
219 VLA-UCB-34f3ed0c-15_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)N(C3=O)CN6CC[NH2+]CC6 −8.3 ± 0.4
220 PET-UNK-94036022-4_1 molecule C#CC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CC(=O)N(C4=O)c5cncc6c5cccc6)Cl −8.2 ± 0.3
221 EDJ-MED-ede5c6cb-1_1 molecule CS(=O)(=O)Nc1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CCS(=O)(=O)c5c4cc(cc5)Cl −8.2 ± 0.2
222 EDJ-MED-d4864bdc-3_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CCS(=O)(=O)c5c4cc(cc5)Cl −8.2 ± 0.1
223 MAT-POS-38eb6498-1_2 molecule C[NH+](C)CCOc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −8.2 ± 0.8
224 LUO-POS-b4dec3be-2_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)F)Cl −8.2 ± 0.3
225 MAT-POS-50a80394-2_3 molecule CC[C@@H]1CN(C(=O)[C@@]12C[N@](Cc3c2cc(cc3)Cl)S(=O)(=O)CC4(CC4)C#N)c5cncc6c5cccc6 −8.2 ± 0.7
226 MAT-POS-c2d406ed-3_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N)NC3=S −8.2 ± 0.3
227 LUO-POS-ed2cfb03-1_1 molecule C[NH+]1CCN(CC1)S(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −8.2 ± 0.3
228 ALP-POS-afe0272e-2_1 molecule CNC(=O)CN1C[C@]2(CCN(C2=O)c3cncc4c3cccc4)c5cc(c(cc5C1=O)Cl)Cl −8.1 ± 0.2
229 MAT-POS-853c0ffa-22_1 molecule CC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5ccc(c6)S(=O)(=O)C)Cl −8.1 ± 0.5
230 ALP-POS-ecbed2ba-18_3 molecule CC[N@@](C)S(=O)(=O)[N@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −8.1 ± 0.3
231 EDJ-MED-5cd3920d-5_2 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C(F)F −8.1 ± 0.5
232 PET-UNK-7e9559de-4_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@H+](Cc5c4cc(cc5)Cl)Cc6nncs6 −8.1 ± 0.2
233 MAT-POS-853c0ffa-14_2 molecule COC1(CC1)CS(=O)(=O)[N@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cc(cc6)F)Cl −8.1 ± 0.4
234 MAT-POS-c7726e07-6_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −8.1 ± 0.3
235 EDJ-MED-98c0a822-2_2 molecule CNC(=O)C1(COC1)[N@]2C[C@]3(CCN(C3=O)c4cncc5c4cccc5)c6cc(ccc6S2(=O)=O)Cl −8.1 ± 0.3
236 MAT-POS-2e8b2191-8_2 molecule CN1C(=O)N(C(=O)[C@@]12C[N@](Cc3c2cc(cc3)Cl)S(=O)(=O)C)c4cncc5c4cccc5 −8.1 ± 0.1
237 MAT-POS-b4d6b7fc-5_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)F)Cl −8.1 ± 0.2
238 EDJ-MED-b6c6ee2b-4_2 molecule c1cc2cncc(c2cc1Cl)N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −8.1 ± 0.5
239 ALP-POS-ecbed2ba-17_1 molecule C[N@@](CC#N)S(=O)(=O)[N@@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −8.0 ± 0.2
240 VLA-MRT-a639d434-2_2 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(C[N@H+](Cc5c4cc(cc5)Cl)CC(=O)N)NC3=O −8.0 ± 0.2
241 LUO-POS-868e8996-9_1 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −8.0 ± 0.4
242 MAT-POS-40ad851a-1_6 molecule C[N@H+]1CCC[C@@H]1COc2ccc3cncc(c3c2)N4CC[C@@]5(C4=O)C[N@](Cc6c5cc(cc6)Cl)S(=O)(=O)CC7(CC7)C#N −8.0 ± 0.9
243 ALP-POS-ecbed2ba-11_2 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CCOCC6)C#N −8.0 ± 0.5
244 LUO-POS-ed2cfb03-2_1 molecule CNS(=O)(=O)[N@@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −8.0 ± 0.2
245 EDJ-MED-ee81482e-3_4 molecule C[NH+](C)C[C@H](COc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N)O −8.0 ± 0.9
246 VLA-MRT-a639d434-2_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(C[N@@H+](Cc5c4cc(cc5)Cl)CC(=O)N)NC3=O −8.0 ± 0.2
247 MAT-POS-69786b79-4_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@H+](Cc5c4cc(cc5)Cl)CC(=O)NC6(CC6)C#N −7.9 ± 0.3
248 EDJ-MED-ee81482e-5_2 molecule c1cc2cncc(c2cc1C[NH+]3CC4(C3)COC4)N5CC[C@@]6(C5=O)C[N@](Cc7c6cc(cc7)Cl)S(=O)(=O)CC8(CC8)C#N −7.9 ± 0.6
249 MAT-POS-50a80394-4_1 molecule C[C@@H]1CN(C(=O)[C@@]12C[N@@H+](Cc3c2cc(cc3)Cl)CC(=O)NC)c4cncc5c4cccc5 −7.9 ± 0.2
250 MAT-POS-38eb6498-3_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)OCC[NH+](C)C)Cl −7.9 ± 0.5
251 ALP-POS-ecbed2ba-7_2 molecule CNC(=O)C1(CC1)[N@H+]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −7.9 ± 0.2
252 ALP-POS-ecbed2ba-6_2 molecule COC1(CC1)CS(=O)(=O)[N@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −7.9 ± 0.4
253 MAT-POS-50a80394-1_2 molecule C[C@H]1CN(C(=O)[C@@]12C[N@@](Cc3c2cc(cc3)Cl)S(=O)(=O)CC4(CC4)C#N)c5cncc6c5cccc6 −7.9 ± 0.4
254 EDJ-MED-a6bab6fb-1_1 molecule Cc1cccc2c1c(cnc2)N3CC[C@@]4(C3)CCOc5c4cc(cc5)Cl −7.9 ± 0.1
255 ALP-POS-ecbed2ba-18_2 molecule CC[N@](C)S(=O)(=O)[N@@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −7.9 ± 0.3
256 EDJ-MED-b6c6ee2b-3_1 molecule COc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.9 ± 0.6
257 PET-UNK-94036022-2_2 molecule C#CC1(CC1)CS(=O)(=O)[N@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −7.8 ± 0.4
258 ALP-POS-ecbed2ba-19_1 molecule C[N@@](CCO)S(=O)(=O)[N@@]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −7.8 ± 0.4
259 EDJ-MED-468565e0-1_2 molecule c1cc2cncc(c2cc1OCC[NH+]3CCCC3)N4CC[C@@]5(C4=O)C[N@](Cc6c5cc(cc6)Cl)S(=O)(=O)CC7(CC7)C#N −7.8 ± 0.8
260 ALP-POS-4483ae88-1_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CNS(=O)(=O)c5c4cc(cc5)Cl −7.8 ± 0.1
261 MAT-POS-853c0ffa-16_1 molecule COC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5ccc(c6)S(=O)(=O)C)Cl −7.8 ± 0.5
262 ALP-POS-ecbed2ba-4_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.8 ± 0.4
263 EDJ-MED-94fddcec-5_1 molecule CS(=O)(=O)c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CCS(=O)(=O)c5c4cc(cc5)Cl −7.8 ± 0.2
264 PET-UNK-94036022-11_1 molecule C#CC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CC(=O)N(C4=O)c5cncc6c5cccc6)Cl −7.7 ± 0.3
265 MAT-POS-40ad851a-2_4 molecule CC[N@H+](C)CCOc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.7 ± 0.7
266 EDJ-MED-d7486dd1-1_1 molecule Cc1cc(cc2c1c(cnc2)N3CC[C@@]4(C3)CCOc5c4cc(cc5)Cl)S(=O)(=O)C −7.7 ± 0.1
267 ALP-POS-ecbed2ba-5_2 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6CS(=O)(=O)C6 −7.7 ± 0.5
268 LUO-POS-868e8996-12_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −7.7 ± 0.2
269 MAT-POS-853c0ffa-9_1 molecule C[NH+](C)CCOc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.7 ± 0.5
270 ALP-POS-41e2080f-1_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CCS(=O)(=O)c5c4cc(cc5)Cl −7.7 ± 0.1
271 PET-UNK-94036022-2_1 molecule C#CC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −7.7 ± 0.3
272 MAT-POS-50a80394-7_1 molecule CC1(CN(C(=O)[C@@]12C[N@@H+](Cc3c2cc(cc3)Cl)CC(=O)NC)c4cncc5c4cccc5)C −7.7 ± 0.2
273 PET-UNK-94036022-5_2 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)Cl −7.7 ± 0.3
274 ALP-POS-ecbed2ba-14_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@H+](Cc5c4cc(cc5)Cl)CC(=O)NCC#N −7.7 ± 0.2
275 EDJ-MED-a6bab6fb-1_2 molecule Cc1cccc2c1c(cnc2)N3CC[C@@]4(C3)CCOc5c4cc(cc5)Cl −7.7 ± 0.1
276 MAT-POS-c2d406ed-2_1 molecule CN1C(=O)N(C(=O)[C@@]12C[N@@](Cc3c2cc(cc3)Cl)S(=O)(=O)CC4(CC4)C#N)c5cncc6c5cccc6 −7.7 ± 0.2
277 MAT-POS-69786b79-3_2 molecule CC1(CC1)NC(=O)C[N@H+]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cccc6)Cl −7.6 ± 0.2
278 VLA-MRT-8c78ee15-4_2 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(C[N@H+](Cc5c4cc(cc5)Cl)CC(=O)N)NC3=O −7.6 ± 0.2
279 MAT-POS-853c0ffa-8_1 molecule COC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5c(cc(c6)F)Cl)Cl −7.6 ± 0.4
280 LUO-POS-868e8996-12_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −7.6 ± 0.2
281 MAT-POS-1bed62cf-3_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CC(=O)N(C3=O)c4cncc5c4cccc5)Cl −7.6 ± 0.2
282 LUO-POS-868e8996-10_2 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.6 ± 0.4
283 MAT-POS-c7726e07-6_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cccc5)Cl −7.6 ± 0.2
284 EDJ-MED-fed7ac0b-4_1 molecule CNC(=O)CN1C[C@]2(C=NN(C2=O)c3cncc4c3cccc4)c5cc(ccc5C1=O)Cl −7.6 ± 0.2
285 EDJ-MED-b6c6ee2b-4_1 molecule c1cc2cncc(c2cc1Cl)N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.6 ± 0.3
286 MAT-POS-853c0ffa-14_1 molecule COC1(CC1)CS(=O)(=O)[N@@]2Cc3ccc(cc3[C@]4(C2)CCN(C4=O)c5cncc6c5cc(cc6)F)Cl −7.6 ± 0.3
287 MAT-POS-b4d6b7fc-5_1 molecule CNC(=O)C[N@@H+]1Cc2ccc(cc2[C@]3(C1)CCN(C3=O)c4cncc5c4cc(cc5)F)Cl −7.6 ± 0.3
288 PET-UNK-94036022-12_2 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)Cl −7.5 ± 0.3
289 EDJ-MED-f9b78f78-4_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)CNS(=O)(=O)c5c4cc(cc5)Cl −7.5 ± 0.2
290 EDJ-MED-d7486dd1-1_2 molecule Cc1cc(cc2c1c(cnc2)N3CC[C@@]4(C3)CCOc5c4cc(cc5)Cl)S(=O)(=O)C −7.5 ± 0.1
291 BRU-THA-55eab31a-1_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCNc5c4cc(cc5)Cl)C=N3 −7.5 ± 0.2
292 EDJ-MED-8bb691af-8_1 molecule CNC(=O)CN1C[C@]2(CCN(C2=O)c3cncc4c3cccc4)c5cc(ccc5C1=O)Cl −7.5 ± 0.2
293 ALP-POS-ecbed2ba-12_1 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@H+](Cc5c4cc(cc5)Cl)CC(=O)NCC6CC6 −7.5 ± 0.3
294 MAT-POS-40ad851a-2_2 molecule CC[N@H+](C)CCOc1ccc2cncc(c2c1)N3CC[C@@]4(C3=O)C[N@@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.5 ± 0.7
295 LUO-POS-868e8996-9_2 molecule c1ccc2c(c1)cncc2N3C(=O)C[C@@]4(C3=O)C[N@](Cc5c4cc(cc5)Cl)S(=O)(=O)CC6(CC6)C#N −7.5 ± 0.4
296 MAT-POS-69786b79-4_2 molecule c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@H+](Cc5c4cc(cc5)Cl)CC(=O)NC6(CC6)C#N −7.5 ± 0.2
297 VLA-MRT-a639d434-1_2 molecule CNC(=O)C[N@H+]1Cc2ccc(cc2[C@@]3(C1)C(=O)N(C(=O)N3)c4cncc5c4cccc5)Cl −7.5 ± 0.2
298 EDJ-MED-7587a9ee-1_2 molecule CN1C(=O)N(C(=O)[C@@]12C[N@](Cc3c2cc(cc3)Cl)S(=O)(=O)C)c4cncc5c4cccc5 −7.5 ± 0.1
299 MAT-POS-c2d406ed-4_1 molecule CN1C(=S)N(C(=O)[C@@]12C[N@@](Cc3c2cc(cc3)Cl)S(=O)(=O)CC4(CC4)C#N)c5cncc6c5cccc6 −7.5 ± 0.3
300 VLA-UNK-f702bf1c-7_1 molecule c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)N(C3=O)CCN6CC[NH2+]CC6 −7.5 ± 0.2
Last updated 2022-01-08T20:00:02.418133+00:00
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