| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 3101 |
MIC-UNK-5a93dd5f-1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)[NH+]4C[C@H]5CCC[C@@H]5C4 |
−5.9
± 0.2
|
| 3102 |
MAK-UNK-3875bbc8-2_2
|
|
CN(c1cncc2c1cccc2)C(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−5.9
± 0.2
|
| 3103 |
EDJ-MED-923a35c2-1_3
|
|
CO[C@@]1(C[N@](Cc2c1cc(cc2)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cc(cc4)S(=O)(=O)C |
−5.9
± 0.3
|
| 3104 |
PET-UNK-9b23ef84-4_2
|
|
CO[C@]1(CN(Cc2c1cc(cc2)Cl)c3nnco3)C(=O)Nc4cncc5c4cccc5 |
−5.9
± 0.3
|
| 3105 |
MAT-POS-61f37a1a-5_2
|
|
Cn1cc(nn1)C[N@H+]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cc(cc5)F)Cl |
−5.90
± 0.10
|
| 3106 |
JOH-UNI-3fc3434e-8_1
|
|
c1ccc2c(c1)cnc(c2NC(=O)Cc3cccc(c3)Cl)C#N |
−5.9
± 0.6
|
| 3107 |
KAD-UNI-8a629cb0-40_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(c(=O)[nH]c5=O)Cl |
−5.9
± 0.5
|
| 3108 |
EDG-MED-ba1ac7b9-16_1
|
|
Cn1cncc1CN(C2CC2)C(=O)C[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−5.90
± 0.07
|
| 3109 |
MAT-POS-1f3f1a6f-2_2
|
|
C[NH+](C)[C@H](c1ccc(c(c1)Cl)Cl)C(=O)Nc2cncc3c2cccc3 |
−5.90
± 0.09
|
| 3110 |
MAT-POS-f9802937-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCNc4c3cc(c(c4)Cl)Cl |
−5.90
± 0.10
|
| 3111 |
VLA-UCB-05e51b3f-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4O[C@H]5CC(=O)N5)Cl)CCC6CCCCC6 |
−5.9
± 0.3
|
| 3112 |
RAL-THA-58fba2bc-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCO |
−5.9
± 0.2
|
| 3113 |
JOH-UNI-ee5ed7c8-8_1
|
|
c1ccc2c(c1)cnc(c2NC(=O)Cc3cccc(c3)Cl)C#N |
−5.9
± 0.5
|
| 3114 |
MAT-POS-4223bc15-28_3
|
|
COCC[N@@H+]1Cc2ccc(cc2[C@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−5.89
± 0.09
|
| 3115 |
PET-UNK-1b92fa34-5_1
|
|
CO[C@]1(CS(=O)(=O)Cc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.9
± 0.3
|
| 3116 |
KAD-UNI-8a629cb0-28_1
|
|
Cc1ccnc2n1nc(n2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−5.9
± 0.4
|
| 3117 |
MIC-UNK-ea4eb352-12_1
|
|
CO[C@@]1(CCSc2c1cc(c(c2)F)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.9
± 0.2
|
| 3118 |
EDG-MED-90036822-8_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](c5c[nH]nc5)F |
−5.9
± 0.4
|
| 3119 |
EDJ-MED-fa7708b3-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@@H+](Cc4c3cc(cc4)Cl)Cc5[nH]ncn5 |
−5.9
± 0.2
|
| 3120 |
ALP-POS-347519b5-3_43
|
|
CS(=O)(=O)[N@@]1C[C@H]2[C@@H]3CC[C@H]([C@@H]2[C@H](C1)C(=O)Nc4cncc5c4cccc5)O3 |
−5.9
± 0.3
|
| 3121 |
ALF-EVA-0b412456-6_2
|
|
CNc1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)O[C@H]4CC(=O)N4 |
−5.9
± 0.4
|
| 3122 |
LAU-MED-88a3970a-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4OCCO)Cl |
−5.9
± 0.1
|
| 3123 |
DAR-DIA-9e4459de-15_2
|
|
c1cc2c(c(c1)NC(=O)CCC(=O)Nc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−5.9
± 0.3
|
| 3124 |
MAK-UNK-c749d764-29_2
|
|
c1ccc2c(c1)cncc2N(C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F)C(=O)ON |
−5.9
± 0.5
|
| 3125 |
ALF-EVA-0b412456-2_1
|
|
COc1ccc2cncc(c2c1)NC(=O)Cc3cc(cc(c3)Cl)O[C@@H]4CC(=O)N4 |
−5.89
± 0.08
|
| 3126 |
DAR-DIA-0587064e-20_1
|
|
c1ccc(cc1)CCOc2cc(cc3c2OCC[C@@H]3C(=O)Nc4cncc5c4cccc5)Cl |
−5.89
± 0.09
|
| 3127 |
MAK-UNK-83e0a0b4-4_1
|
|
CCCCc1ccc2c(c1)[C@@H](CCO2)C(=O)N(CCNC3C[NH2+]C3)c4cncc5c4cccc5 |
−5.9
± 0.3
|
| 3128 |
RAL-THA-6e4c80cf-3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CN(Cc4c3cc(cc4)Cl)C(=O)OCc5cncs5 |
−5.88
± 0.09
|
| 3129 |
ALP-POS-5bb456a5-1_8
|
|
C[C@H]1C[N@](CC[C@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−5.88
± 0.09
|
| 3130 |
KAD-UNI-877d7bed-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4OCCOc5ccc(cc5)S(=O)(=O)N)Cl |
−5.9
± 0.2
|
| 3131 |
ALP-UNI-76695c4f-10_3
|
|
C[C@@]12CN(C[C@]1(C(=O)NC2=O)C)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−5.9
± 0.3
|
| 3132 |
VLA-UCB-1dbca3b4-12_2
|
|
c1ccc2c(c1)cncc2n3c(c(n(c3=O)CC4CCCCC4)c5cccc(c5)Cl)[O-] |
−5.9
± 0.4
|
| 3133 |
ALP-UNI-dbbfd3db-6_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC[C@H](O5)C(=O)N6CCCC6 |
−5.9
± 0.3
|
| 3134 |
EDG-MED-4c68219f-13_1
|
|
C[NH+](C)CCCNC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.9
± 0.6
|
| 3135 |
MAT-POS-45b13633-3_1
|
|
C[NH+](C)C[C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.88
± 0.10
|
| 3136 |
MAR-UCB-f313ec4d-3_1
|
|
COc1ccccc1OCCC(=O)Nc2cncc3c2cccc3 |
−5.88
± 0.10
|
| 3137 |
PET-UNK-8c422e11-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)OC(F)F |
−5.9
± 0.2
|
| 3138 |
RAL-THA-2d450e86-34_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccncc3Cl |
−5.88
± 0.10
|
| 3139 |
EDJ-MED-1981ceba-5_1
|
|
C[NH+]1CCN(CC1)S(=O)(=O)[N@@]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cccc5)Cl |
−5.9
± 0.3
|
| 3140 |
KAD-UNI-877d7bed-4_2
|
|
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCOc3cc(cc4c3OCC[C@H]4C(=O)Nc5cncc6c5cccc6)Cl |
−5.9
± 0.2
|
| 3141 |
ALF-EVA-0b412456-1_2
|
|
c1cc2cncc(c2cc1Cl)NC(=O)Cc3cc(cc(c3)Cl)O[C@H]4CC(=O)N4 |
−5.87
± 0.09
|
| 3142 |
MAT-POS-4223bc15-16_10
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)[N@@]5CCC[C@H]5CO |
−5.9
± 0.3
|
| 3143 |
LON-WEI-5e7d1b3e-35_3
|
|
Cc1ccc(cc1)C[N@@H+]2CC[C@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−5.9
± 0.3
|
| 3144 |
ALP-POS-347519b5-3_60
|
|
CS(=O)(=O)[N@]1C[C@H]2[C@@H]3CC[C@H]([C@H]2[C@H](C1)C(=O)Nc4cncc5c4cccc5)O3 |
−5.9
± 0.3
|
| 3145 |
EDJ-MED-cf877e1d-1_4
|
|
CN(C)S(=O)(=O)[N@]1Cc2cc(c(cc2[C@H](C1)C(=O)Nc3cncc4c3cccc4)Cl)F |
−5.9
± 0.2
|
| 3146 |
KAD-UNI-877d7bed-9_4
|
|
Cn1cc(cn1)C[N@H+]2C[C@H]2COc3cc(cc4c3OCC[C@@H]4C(=O)Nc5cncc6c5cccc6)Cl |
−5.9
± 0.2
|
| 3147 |
ALP-POS-a0a4abd7-8_1
|
|
Cn1cc(c(=O)[nH]c1=O)CCN(c2cncc3c2cccc3)C(=O)[C@@H]4CCOc5c4ccc(c5)Cl |
−5.9
± 0.2
|
| 3148 |
RAL-THA-e002e396-2_2
|
|
CCS(=O)(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.9
± 0.2
|
| 3149 |
MAT-POS-e6dd326d-2_2
|
|
C[NH2+]C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.9
± 0.3
|
| 3150 |
EDG-MED-90036822-78_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]([C@@H](C5CC5)O)F |
−5.9
± 0.4
|
| 3151 |
LON-WEI-4d77710c-57_1
|
|
CC(C)OCCCN(Cc1ccco1)C(=O)Nc2cn(c(=O)c3c2cccc3)C |
−5.9
± 0.2
|
| 3152 |
MAT-POS-932d1078-2_1
|
|
CO[C@@]1(CCOc2c1cc(cc2F)F)C(=O)Nc3cncc4c3cccc4 |
−5.86
± 0.07
|
| 3153 |
MIC-UNK-50cce87d-10_1
|
|
c1cc(cc(c1)Cl)[C@@H]2CCCN(C2=O)c3cncc4c3c(ccc4)Cl |
−5.9
± 0.2
|
| 3154 |
RAL-THA-8416115c-6_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5ccn[nH]5 |
−5.86
± 0.10
|
| 3155 |
EDG-MED-ba1ac7b9-13_4
|
|
C[N@H+]1C[C@@H]2C[C@H]1CN2C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−5.86
± 0.10
|
| 3156 |
KAD-UNI-8a629cb0-43_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@@H]5C[C@H]6[C@@H]5C[C@@H](C6)C(=O)N |
−5.9
± 0.4
|
| 3157 |
LON-WEI-5e7d1b3e-57_1
|
|
CC(C)OCCCN(Cc1ccco1)C(=O)Nc2cn(c(=O)c3c2cccc3)C |
−5.9
± 0.2
|
| 3158 |
MAT-POS-4223bc15-9_14
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@H]5CCC[C@H]5O |
−5.9
± 0.2
|
| 3159 |
EDJ-MED-e9a22d5d-2_4
|
|
CNS(=O)(=O)[N@]1Cc2ccc(cc2[C@](C1)(C(=O)Nc3cncc4c3cccc4)OCC#C)Cl |
−5.9
± 0.3
|
| 3160 |
EDG-MED-90036822-44_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(=O)CCF |
−5.9
± 0.5
|
| 3161 |
VLA-UNK-4b5c0188-1_4
|
|
c1ccc2c(c1)cncc2N(C[C@H]3CO3)C(=O)[C@H]4CCOc5c4cc(cc5)Cl |
−5.9
± 0.2
|
| 3162 |
MAT-POS-4223bc15-9_12
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@@H]5CCC[C@H]5O |
−5.9
± 0.2
|
| 3163 |
DAR-DIA-b4e9dd8d-3_1
|
|
COC(=O)/C=C/C(=O)N(c1cncc2c1cccc2)C(=O)[C@H]3COc4c3cc(cc4)Cl |
−5.85
± 0.09
|
| 3164 |
DAR-DIA-23e5a6a0-5_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@H]5CC6([NH2+]5)CC6)Cl |
−5.9
± 0.3
|
| 3165 |
MAT-POS-4223bc15-13_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@@H]5CC[C@@H]5O |
−5.8
± 0.3
|
| 3166 |
MIC-UNK-06e5f114-4_2
|
|
CS(=O)(=O)[N@]1CC[C@@H](C1)[NH2+]Cc2ccc(cc2CC(=O)Nc3cncc4c3cccc4)Cl |
−5.8
± 0.4
|
| 3167 |
VLA-UCB-05e51b3f-6_1
|
|
c1ccc2c(c1)cncc2N3C(=O)CC[C@]4(C3=O)CCOc5c4cc(cc5)Cl |
−5.8
± 0.2
|
| 3168 |
ALF-EVA-07677224-8_1
|
|
Cn1cc(nc1)S(=O)(=O)[N@@]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cccc5)Cl |
−5.8
± 0.1
|
| 3169 |
EDG-MED-90036822-19_1
|
|
Cn1ccnc1[C@@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−5.8
± 0.4
|
| 3170 |
DAR-DIA-6a508060-5_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4C[C@H]5CC(=O)N5)Cl |
−5.8
± 0.5
|
| 3171 |
NIR-WEI-f9286bb6-1_2
|
|
CNC(=O)[C@H](c1cncc2c1cccc2)N(Cc3ccccc3Cl)C(=O)C=C |
−5.85
± 0.10
|
| 3172 |
MAT-POS-dc2604c4-1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)CC5(CC5)C#N |
−5.8
± 0.3
|
| 3173 |
ED_-GRI-5b13fbe2-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H](C[NH3+])c5n[n-]nn5 |
−5.8
± 0.3
|
| 3174 |
MAT-POS-5369c344-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4OCc5ccncc5)Cl |
−5.84
± 0.09
|
| 3175 |
EDG-MED-90036822-94_11
|
|
C[C@@H]1C[C@H]1[C@@H]([C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F)O |
−5.8
± 0.3
|
| 3176 |
RAL-THA-2d450e86-4_1
|
|
COc1ccc(cc1)CC(=O)Nc2cncc3c2cccc3 |
−5.84
± 0.09
|
| 3177 |
LON-WEI-5e7d1b3e-37_1
|
|
CCN(CC)S(=O)(=O)c1ccc(cc1)NC(=O)Nc2cn(c(=O)c3c2cccc3)C |
−5.8
± 0.4
|
| 3178 |
EDG-MED-90036822-59_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC[C@@H](CF)[NH3+] |
−5.8
± 0.6
|
| 3179 |
MAT-POS-fb82b63d-4_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3c4cc(ccc4CC[N@H+]3CC5CC5)Cl |
−5.8
± 0.2
|
| 3180 |
MAK-UNK-c749d764-15_9
|
|
C[C@@H](N(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@@H]([C@H]3O)C(F)F)OCC4CCCCC4 |
−5.8
± 0.5
|
| 3181 |
VLA-UNK-5c5a631c-2_1
|
|
c1ccc2c(c1)cncc2N(CCC=O)C(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−5.8
± 0.2
|
| 3182 |
JOH-UNI-f51e3bbc-1_2
|
|
c1ccc2c(c1)c(c[nH]c2=O)NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−5.83
± 0.09
|
| 3183 |
EDJ-MED-e9a22d5d-2_3
|
|
CNS(=O)(=O)[N@@]1Cc2ccc(cc2[C@](C1)(C(=O)Nc3cncc4c3cccc4)OCC#C)Cl |
−5.8
± 0.2
|
| 3184 |
ERI-UCB-b3e6b0c2-19_1
|
|
COCCOc1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)COc5c4cc(cc5)Cl |
−5.8
± 0.2
|
| 3185 |
EDJ-MED-15e90dfc-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)C[NH2+]Cc5ccccn5 |
−5.8
± 0.2
|
| 3186 |
EDJ-MED-1981ceba-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)N5CCOCC5 |
−5.8
± 0.3
|
| 3187 |
RAL-THA-e002e396-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CS(=O)(=O)N5CC[NH2+]CC5 |
−5.8
± 0.1
|
| 3188 |
EDJ-MED-e4b030d8-7_1
|
|
COc1cc(cc2c1OCC[C@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−5.82
± 0.10
|
| 3189 |
MIC-UNK-cdc2493e-15_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(CC[C@@H]3CCCS3(=O)=O)c4cccc(c4)Cl |
−5.8
± 0.3
|
| 3190 |
DAR-DIA-9e4459de-11_2
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−5.8
± 0.3
|
| 3191 |
LON-WEI-5e7d1b3e-1_1
|
|
Cn1cc(c2ccccc2c1=O)NC(=O)NCc3cc(ccc3OC)OC |
−5.8
± 0.5
|
| 3192 |
EDG-MED-90036822-90_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](c5ccccc5F)[NH3+] |
−5.8
± 0.4
|
| 3193 |
RAL-THA-2d450e86-18_1
|
|
COc1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3 |
−5.8
± 0.4
|
| 3194 |
DAR-DIA-9e4459de-11_15
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@H]7CCC(=O)NC7=O)O |
−5.8
± 0.3
|
| 3195 |
ALF-EVA-ced740bd-3_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3COc4c3cc(cc4)F |
−5.8
± 0.1
|
| 3196 |
PET-UNK-03fd2068-6_2
|
|
CS(=O)(=O)[N@]1Cc2cc(c(cc2[C@@H](C1)C(=O)Nc3cncc4c3ccc(c4)F)Cl)F |
−5.8
± 0.2
|
| 3197 |
MAT-POS-4223bc15-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)C5COC5 |
−5.81
± 0.09
|
| 3198 |
PET-UNK-acd70dee-1_1
|
|
CN(C)C(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−5.8
± 0.2
|
| 3199 |
MIC-UNK-50cce87d-8_2
|
|
COc1cccc2c1c(cnc2)N3CC[C@H](C3=O)c4cccc(c4)Cl |
−5.8
± 0.2
|
| 3200 |
RYA-UNI-8a7f7a0d-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3ccc(cc3)Cl)c4cc(cc(c4)Cl)O[C@@H]5CC(=O)N5 |
−5.8
± 0.2
|