| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 2801 |
EN300-182758_1_1_1 |
|
Cc1nc(no1)Cn2cc(nn2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.7
± 0.3
|
| 2802 |
EN300-113633_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5CCC(=O)NC5=O |
−9.7
± 0.2
|
| 2803 |
EN300-37077_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)c5ccn[nH]5 |
−9.7
± 0.3
|
| 2804 |
EN300-1091444_1_1_1 |
|
CN(C1COC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2805 |
EN300-113112_2_1_1 |
|
Cn1cnnc1COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.2
|
| 2806 |
EN300-1387243_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCO[C@H]6[C@H]5COCC6 |
−9.7
± 0.3
|
| 2807 |
EN300-184355_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@H](C(=O)N)O |
−9.7
± 0.4
|
| 2808 |
EN300-706065_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C(C5(CCOCC5)O)(F)F |
−9.7
± 0.3
|
| 2809 |
EDJ-MED-40433386-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@]5(CCOC5)C#N |
−9.7
± 0.3
|
| 2810 |
EN300-1601684_3_1_1 |
|
CC1([C@@H](OCCO1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.7
± 0.4
|
| 2811 |
EN300-154332_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]5CO |
−9.7
± 0.3
|
| 2812 |
EN300-7471076_1_2_1 |
|
C[C@H]1[C@@H](CN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.7
± 0.3
|
| 2813 |
EN300-6473273_1_2_1 |
|
Cn1c(ccn1)[C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.7
± 0.2
|
| 2814 |
EN300-6473273_1_2_1 |
|
Cn1c(ccn1)[C@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.7
± 0.2
|
| 2815 |
EDG-MED-90036822-84_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(C#N)(F)F |
−9.7
± 0.2
|
| 2816 |
EN300-6481287_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)O[C@H]5[C@@H](C[C@H]6[C@@H]5CC6=O)O |
−9.7
± 0.3
|
| 2817 |
EN300-1710153_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C(C5)(F)F)O |
−9.7
± 0.2
|
| 2818 |
EN300-649743_1_1_1 |
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)Cn5cnnn5 |
−9.7
± 0.4
|
| 2819 |
EN300-36390_1_1_1 |
|
CCOC(=O)NCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.2
|
| 2820 |
EN300-48902_3_1_1 |
|
CNC(=O)[C@@H]1CCCN1C(=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.4
|
| 2821 |
EN300-248526_2_2_1 |
|
c1ccc(cc1)[C@](COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)(C(=O)N)O |
−9.7
± 0.3
|
| 2822 |
EN300-107267_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)O[C@@H]5CCCNC5=O |
−9.7
± 0.3
|
| 2823 |
EN300-148421_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@]5(CCOC5)O |
−9.7
± 0.3
|
| 2824 |
EN300-98018_3_2_1 |
|
CC(=O)N1CC[C@](C1)(C)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.4
|
| 2825 |
EN300-202922_1_4_1 |
|
C[C@H]([C@](C)(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)O |
−9.7
± 0.3
|
| 2826 |
EN300-1915260_3_2_1 |
|
COC[C@H](COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.3
|
| 2827 |
EN300-30458_3_2_1 |
|
CN1CC[C@H](CC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2828 |
EN300-198540_3_2_1 |
|
C[n+]1cc(c[nH]1)[C@H](C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−9.7
± 0.5
|
| 2829 |
EN300-298552_1_1_1 |
|
CO[C@@H]([C@@H]1CCOC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.2
|
| 2830 |
EN300-196962_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5C[C@H]5CO |
−9.7
± 0.2
|
| 2831 |
EN300-65063_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCN(CC5)C(=O)N |
−9.7
± 0.3
|
| 2832 |
EN300-261365_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CS(=O)(=O)C5 |
−9.7
± 0.2
|
| 2833 |
EN300-155362_1_2_1 |
|
C[C@H]1CC(=O)N[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.2
|
| 2834 |
EN300-52768_1_1_1 |
|
CCCS(=O)(=O)[C@@H](C)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2835 |
EN300-1265946_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC(CC5)C(=O)N |
−9.7
± 0.3
|
| 2836 |
EN300-215799_1_1_1 |
|
Cc1c(c(no1)CO)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2837 |
EN300-266117_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@H](C5)O |
−9.7
± 0.3
|
| 2838 |
EN300-21009_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H]5CCCO5 |
−9.7
± 0.3
|
| 2839 |
EN300-260816_2_1_1 |
|
CN1CC[C@@H](C1=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.2
|
| 2840 |
EN300-87334_2_1_1 |
|
Cn1c(ncn1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2841 |
MAK-UNK-83e0a0b4-3_1_1
|
|
c1ccc2c(c1)cncc2N(CCNC3C[NH2+]C3)C(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−9.7
± 0.5
|
| 2842 |
EN300-6739414_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5Cc6ccnn6C[C@H](C5)CO |
−9.7
± 0.3
|
| 2843 |
EN300-54922_1_1_1 |
|
CS(=O)(=O)[N@]1CCC[C@@H](C1)NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.2
|
| 2844 |
EDG-MED-971238d3-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCO |
−9.7
± 0.2
|
| 2845 |
EDG-MED-90036822-94_1
|
|
C[C@@H]1C[C@@H]1[C@@H]([C@@H](C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F)O |
−9.7
± 0.3
|
| 2846 |
EN300-124052_1_2_1 |
|
C[C@H]1CN(C[C@@H]1O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2847 |
ED_-GRI-5b13fbe2-15_1
|
|
C[N@@](CC[NH3+])CCOCCO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.5
|
| 2848 |
EN300-25986_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCn5cccn5 |
−9.7
± 0.2
|
| 2849 |
EN300-7459540_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@@H]5[C@@H](CO)O |
−9.7
± 0.4
|
| 2850 |
EDJ-MED-e4b030d8-11_1
|
|
C[C@H]1COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−9.70
± 0.05
|
| 2851 |
EN300-01527_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)NC[C@@H]5CCCO5 |
−9.7
± 0.4
|
| 2852 |
EN300-68794_4_1_1 |
|
CS(=O)(=O)CCCOCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2853 |
EN300-1073320_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H](C5(CCC5)O)O |
−9.7
± 0.4
|
| 2854 |
ALP-UNI-0676e700-23_1
|
|
Cn1cc(nn1)c2cc(no2)C(=O)NC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.7
± 0.3
|
| 2855 |
DAR-DIA-0d514e7d-25_1
|
|
C[C@H]1COc2c(cc(cc2OC)Cl)[C@]1(C)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.1
|
| 2856 |
EN300-218116_1_1_1 |
|
CC(CO)(CO)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2857 |
EN300-6478433_1_1_1 |
|
CCn1c(nn(c1=O)CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.7
± 0.3
|
| 2858 |
EN300-07936_1_1_1 |
|
CCN(CC(=O)NC(C)C)C(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2859 |
EN300-201164_1_2_1 |
|
CC(C)(C)[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)N |
−9.7
± 0.3
|
| 2860 |
EN300-131943_2_1_1 |
|
COc1cc(ncn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2861 |
EN300-2007564_3_2_1 |
|
CC1([C@H](CCS1(=O)=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.7
± 0.4
|
| 2862 |
EN300-41507_1_1_1 |
|
Cc1nccn1CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2863 |
EN300-305294_1_6_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H]6C[C@@H]([C@H]6C5)O |
−9.7
± 0.3
|
| 2864 |
EN300-23317_4_1_1 |
|
C[C@@H](C(=O)NCCOC)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2865 |
EN300-175425_1_2_1 |
|
CC[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)C(=O)OC |
−9.7
± 0.2
|
| 2866 |
EN300-132157_1_1_1 |
|
C[C@@]1(CC(=O)NC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2867 |
EN300-185729_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCc6c(n[nH]n6)C5 |
−9.7
± 0.2
|
| 2868 |
EN300-1915260_1_2_1 |
|
COC[C@H](CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.3
|
| 2869 |
KAD-UNI-8a629cb0-4_1
|
|
Cn1cc(cc1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−9.7
± 0.3
|
| 2870 |
EN300-41507_3_1_1 |
|
Cc1nccn1CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2871 |
EN300-198515_1_1_1 |
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5cnc(n5)C#N |
−9.7
± 0.2
|
| 2872 |
EN300-97300_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@@H]5F |
−9.7
± 0.2
|
| 2873 |
EDG-MED-90036822-69_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC[C@@](C5)(C[NH3+])F |
−9.7
± 0.4
|
| 2874 |
EN300-301690_1_1_1 |
|
CS(=O)(=O)[N@]1CC[C@@H](C1)O[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2875 |
EN300-120562_1_1_1 |
|
C[C@@H]1C[N@@]2CC[N@H+]1[C@@H](C2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.7
± 0.4
|
| 2876 |
EN300-41366_1_1_1 |
|
Cc1nc(n(n1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.7
± 0.3
|
| 2877 |
EN300-201346_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5COC(=O)N5 |
−9.7
± 0.3
|
| 2878 |
EN300-151423_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CC5(CCOCC5)O |
−9.7
± 0.3
|
| 2879 |
EN300-722418_1_2_1 |
|
C[C@H](CN(C[C@@H](C)O)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.4
|
| 2880 |
EN300-219531_1_1_1 |
|
CCC[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−9.7
± 0.3
|
| 2881 |
DAR-DIA-9e4459de-13_5
|
|
c1cc2c(c(c1)NCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@H]7CCC(=O)NC7=O)O |
−9.7
± 0.4
|
| 2882 |
EN300-317082_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC5COC5 |
−9.7
± 0.2
|
| 2883 |
EN300-10895_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NCCC#N |
−9.7
± 0.3
|
| 2884 |
DAR-DIA-23e5a6a0-3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@H]5CC6([NH2+]5)COC6)Cl |
−9.7
± 0.4
|
| 2885 |
EN300-17381_1_2_1 |
|
C[C@H](C(=O)N)O[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.2
|
| 2886 |
EN300-17381_1_2_1 |
|
C[C@H](C(=O)N)O[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.2
|
| 2887 |
EN300-17381_1_2_1 |
|
C[C@H](C(=O)N)O[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.2
|
| 2888 |
EN300-210553_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@@](C5)(C(=O)N)O |
−9.7
± 0.5
|
| 2889 |
EN300-210553_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@@](C5)(C(=O)N)O |
−9.7
± 0.5
|
| 2890 |
EDJ-MED-4c7486ba-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@]5CC(F)(F)F |
−9.7
± 0.4
|
| 2891 |
EN300-50561_1_1_1 |
|
Cc1nnc2n1C[C@@H](CC2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−9.7
± 0.3
|
| 2892 |
EDJ-MED-e4b030d8-11_1_1
|
|
C[C@H]1COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−9.67
± 0.06
|
| 2893 |
EN300-218116_2_1_1 |
|
CC(CO)(CO)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−9.7
± 0.4
|
| 2894 |
DAR-DIA-5ff57136-9_1_1
|
|
COC(=O)/C=C/C(=O)N(c1cncc2c1cccc2)C(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−9.7
± 0.3
|
| 2895 |
EN300-1605226_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC6(C5)CNC(=O)N6 |
−9.7
± 0.2
|
| 2896 |
EN300-90142_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCC[C@@H](C5)C(=O)N |
−9.7
± 0.3
|
| 2897 |
EN300-100689_1_2_1 |
|
CC(=O)N1CCO[C@H](C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−9.7
± 0.3
|
| 2898 |
EN300-6744028_2_7_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5C[C@@H]6C[C@H]5[C@H]([C@H]6O)O |
−9.7
± 0.3
|
| 2899 |
EN300-64247_3_1_1 |
|
CC(C)(C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)[NH+]5CCOCC5 |
−9.7
± 0.5
|
| 2900 |
EN300-1694056_1_1_1 |
|
CC1([C@@H](CC(=O)N1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−9.7
± 0.3
|