| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 5801 |
MAT-POS-8a69d52e-7_1
|
|
C[C@@H]1COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−7.99
± 0.09
|
| 5802 |
RAL-THA-4aa06b95-4_2
|
|
CN(C)C(=O)N1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.0
± 0.3
|
| 5803 |
EN300-15308_1_1_1 |
|
CS(=O)(=O)N1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.4
|
| 5804 |
MIC-UNK-cdc2493e-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)[C@@H]4CCc5ccccc5C4 |
−8.0
± 0.4
|
| 5805 |
EDJ-MED-e4b030d8-3_1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.98
± 0.07
|
| 5806 |
EN300-53423_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CCOC5 |
−8.0
± 0.5
|
| 5807 |
EN300-1717630_1_1_1 |
|
C[C@@]1(CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−8.0
± 0.3
|
| 5808 |
EN300-718785_4_2_1 |
|
CCN1[C@H](CCC1=O)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.4
|
| 5809 |
EN300-109535_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C[C@H]5CC(=O)OC5 |
−8.0
± 0.2
|
| 5810 |
MAT-POS-e9e99895-8_4
|
|
Cc1nc2n(n1)C[C@H](CC2)C(=O)N[C@](C)(c3ccc(c(c3)Cl)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.4
|
| 5811 |
EN300-256798_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@@H]5CCc6nnnn6CC5 |
−8.0
± 0.3
|
| 5812 |
EDJ-MED-9e38fd34-3_1
|
|
C[C@@]1(c2cc(ccc2NC1=O)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.0
± 0.3
|
| 5813 |
EN300-217494_2_3_1 |
|
C[C@@]([C@H]1CCOC1)(C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.0
± 0.3
|
| 5814 |
IVS-FNM-f9a14d04-1_1
|
|
COc1c(cccc1Cl)CCCC(=O)Nc2cncc3c2cccc3 |
−8.0
± 0.4
|
| 5815 |
MIC-UNK-50cce87d-3_1
|
|
Cc1cccc2c1c(cnc2)NC(=O)Cc3cccc(c3)Cl |
−8.0
± 0.2
|
| 5816 |
EN300-246440_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CC5)n6cncn6 |
−8.0
± 0.3
|
| 5817 |
EN300-1268020_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[NH+](CC5)Cc6n[n-]nn6 |
−8.0
± 0.4
|
| 5818 |
ADA-UCB-dc2b944c-12_1
|
|
Cc1c2ccccc2c(cn1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.97
± 0.08
|
| 5819 |
EN300-183231_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCc5n[n-]nn5 |
−8.0
± 0.3
|
| 5820 |
EN300-1265948_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)N5CCS(=O)(=O)CC5 |
−8.0
± 0.3
|
| 5821 |
EN300-6745081_3_1_1 |
|
C[C@@]1(CCCCNC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.3
|
| 5822 |
EN300-182725_2_1_1 |
|
C[C@@H]([C@@H](C)S(=O)(=O)C)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.0
± 0.3
|
| 5823 |
EN300-173536_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@H]5CCS5(=O)=O |
−8.0
± 0.3
|
| 5824 |
EN300-120119_2_1_1 |
|
CN([C@@H]1CCNC1=O)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.3
|
| 5825 |
EN300-260642_2_1_1 |
|
Cc1c(c(=O)[nH][nH]1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.3
|
| 5826 |
MAT-POS-43fe65f4-1_1
|
|
COc1cc(cc2c1OCC[C@@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−8.0
± 0.2
|
| 5827 |
EN300-1448603_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5CCS(=O)(=O)C5 |
−8.0
± 0.3
|
| 5828 |
EDG-MED-90036822-73_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5[C@@H]6[N@H+]5CCC6 |
−8.0
± 0.2
|
| 5829 |
EDG-MED-90036822-90_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](c5ccccc5F)[NH3+] |
−8.0
± 0.3
|
| 5830 |
RAL-THA-8416115c-10_4
|
|
CNC(=O)CN1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.0
± 0.4
|
| 5831 |
ALF-EVA-0b412456-3_2
|
|
Cc1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)O[C@H]4CC(=O)N4 |
−8.0
± 0.4
|
| 5832 |
EN300-219330_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCN5CCOCC5=O |
−8.0
± 0.3
|
| 5833 |
MAK-UNK-c749d764-26_8
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@H]3CCCC[C@H]([C@H]3O)Cl |
−8.0
± 0.3
|
| 5834 |
EN300-36123_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6[C@H](C5)C6CO |
−8.0
± 0.3
|
| 5835 |
EN300-6505003_4_3_1 |
|
C[C@@H]1CC[C@H](C(=O)N1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.4
|
| 5836 |
KAD-UNI-8a629cb0-28_1
|
|
Cc1ccnc2n1nc(n2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.0
± 0.3
|
| 5837 |
EDG-MED-4c68219f-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)c5n[n-]nn5 |
−8.0
± 0.3
|
| 5838 |
ED_-GRI-5b13fbe2-16_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H](c5cn(nn5)CC6CC6)[NH3+] |
−8.0
± 0.4
|
| 5839 |
EN300-6477724_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H]5C[C@@H]5c6[nH]ncn6 |
−8.0
± 0.4
|
| 5840 |
EN300-6497444_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cnn6c5OC[C@H](C6)O |
−8.0
± 0.4
|
| 5841 |
JOH-UNI-ea72002d-5_1
|
|
C=CS(=O)(=O)NN(c1cncc2c1cccc2)C(=O)[C@@]3(CCOc4c3cc(cc4)Cl)F |
−8.0
± 0.2
|
| 5842 |
MIC-UNK-cdc2493e-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)C4C[C@H]5CCC[C@H]5C4 |
−8.0
± 0.3
|
| 5843 |
MAT-POS-e9e99895-7_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)Cc4ccc(cc4)n5cnnn5 |
−8.0
± 0.4
|
| 5844 |
EN300-6729747_1_1_2 |
|
C[C@H]1NN[C@@H]2[N@H+]1C[C@@H](C2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.0
± 0.5
|
| 5845 |
EN300-177118_1_1_1 |
|
C[C@@]1(CCC(=O)N1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.0
± 0.2
|
| 5846 |
EN300-1387104_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H]5CCS5(=O)=O |
−8.0
± 0.4
|
| 5847 |
NAU-LAT-2fed8305-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)C3(COC3)c4cccc(c4)Cl |
−7.9
± 0.2
|
| 5848 |
EN300-113633_1_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@H]5CCC(=O)NC5=O |
−7.9
± 0.3
|
| 5849 |
LAU-MED-88a3970a-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4CCCCO)Cl |
−7.9
± 0.4
|
| 5850 |
EN300-153257_2_2_1 |
|
CC(C)[C@H](CO)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
| 5851 |
EN300-155764_1_1_1 |
|
C[C@@H]1C(=O)N(CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−7.9
± 0.3
|
| 5852 |
EN300-6760278_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@H]5C[C@@H]6[C@@H](O5)CCO6 |
−7.9
± 0.3
|
| 5853 |
EN300-314274_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cncc6c5CCNC6=O |
−7.9
± 0.3
|
| 5854 |
EN300-6736515_2_2_1 |
|
C[C@H]([C@@H]1COCCO1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5855 |
MAT-POS-c7771779-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CC(=O)Nc4c3cc(cc4)Cl)O |
−7.9
± 0.4
|
| 5856 |
MAT-POS-e9e99895-1_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)[NH3+] |
−7.9
± 0.3
|
| 5857 |
DAR-DIA-0d514e7d-2_1
|
|
C[C@@H]1COc2c(cc(cc2OC)Cl)[C@@H]1C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
| 5858 |
MAT-POS-fce787c2-3_2
|
|
C[C@H](c1ccc(c(c1)Cl)Cl)C(=O)Nc2cncc3c2cccc3 |
−7.9
± 0.3
|
| 5859 |
DAR-DIA-9e4459de-13_16
|
|
c1cc2c(c(c1)NCOCCOc3ccc4c(c3)cncc4NC(=O)[C@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@H]7CCC(=O)NC7=O)O |
−7.9
± 0.4
|
| 5860 |
EN300-52210_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)C[C@H]([NH2+]6)O |
−7.9
± 0.5
|
| 5861 |
EN300-52210_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)C[C@H]([NH2+]6)O |
−7.9
± 0.5
|
| 5862 |
EDJ-MED-ee07cf00-12_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)COc4ccc(cc4)C(=O)N |
−7.9
± 0.4
|
| 5863 |
EN300-246501_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)C6CS(=O)(=O)C6 |
−7.9
± 0.3
|
| 5864 |
NAU-LAT-2fed8305-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CC3)c4cccc(c4)Cl |
−7.9
± 0.3
|
| 5865 |
MAK-UNK-c749d764-12_3
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCC[C@H]([C@@H]3O)Cl |
−7.9
± 0.3
|
| 5866 |
EN300-124063_2_1_1 |
|
Cn1c(ncn1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5867 |
EN300-749499_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H](C5(CCOCC5)O)O |
−7.9
± 0.3
|
| 5868 |
EN300-332601_2_2_1 |
|
CC[C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C |
−7.9
± 0.4
|
| 5869 |
MAT-POS-9ff17035-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)Oc4cccc(=O)[nH]4 |
−7.93
± 0.10
|
| 5870 |
EN300-6736890_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5COC[C@@H]5n6ccnc6 |
−7.9
± 0.3
|
| 5871 |
NAU-LAT-2fed8305-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(s3)Cl |
−7.9
± 0.3
|
| 5872 |
EDG-MED-ba1ac7b9-10_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCC[C@@H]5c6ccn[nH]6 |
−7.9
± 0.6
|
| 5873 |
EN300-194442_1_1_1 |
|
C[C@@]1(CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C(=O)N |
−7.9
± 0.4
|
| 5874 |
EDJ-MED-50011917-3_2
|
|
COc1c(cc(cc1CC(=O)Nc2cncc3c2cccc3)Cl)C[C@H]4CC(=O)N4 |
−7.9
± 0.4
|
| 5875 |
NAU-LAT-30527ac5-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc4c3[nH]cc4)Cl |
−7.9
± 0.3
|
| 5876 |
ALP-POS-fab80cf2-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C([C@@H]4CC(=O)N4)(F)F |
−7.9
± 0.4
|
| 5877 |
DAR-DIA-0d514e7d-32_31
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3[C@H]4C[C@H]4CO[C@H]5[C@H]3C=C(C=C5)Cl |
−7.9
± 0.3
|
| 5878 |
EN300-300217_4_3_1 |
|
C/C=C\[C@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.9
± 0.4
|
| 5879 |
ED_-GRI-5b13fbe2-66_1
|
|
C[N@@H+]1CCO[C@@H](C1)c2ncc(cn2)CO[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.9
± 0.2
|
| 5880 |
RAL-THA-2d450e86-4_1
|
|
COc1ccc(cc1)CC(=O)Nc2cncc3c2cccc3 |
−7.9
± 0.3
|
| 5881 |
EN300-7444533_2_1_1 |
|
C[C@@H]1C[C@@H](C(=O)O1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5882 |
EN300-1087187_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6CCC(=O)N[C@@H]6C5 |
−7.9
± 0.3
|
| 5883 |
RAL-THA-05e671eb-16_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4Cl)Cl |
−7.9
± 0.2
|
| 5884 |
EN300-316679_4_1_1 |
|
CCC[C@@H](C(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.9
± 0.3
|
| 5885 |
EDJ-MED-9e38fd34-4_2
|
|
C[C@]1(c2cc(c(cc2NC1=O)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
| 5886 |
EN300-749499_3_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@H](C5(CCOCC5)O)O |
−7.9
± 0.4
|
| 5887 |
RAL-THA-8416115c-3_3
|
|
CCN1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.9
± 0.3
|
| 5888 |
EN300-219020_4_1_1 |
|
Cn1ncc(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5889 |
EN300-219020_4_1_1 |
|
Cn1ncc(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5890 |
EN300-185751_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cc5cncnc5 |
−7.9
± 0.2
|
| 5891 |
ALP-UNI-3496895b-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCN(CC5)CCC#N |
−7.9
± 0.3
|
| 5892 |
EDJ-MED-ee07cf00-3_1
|
|
Cn1c2c(cn1)c(=O)n(cn2)CC(=O)N[C@@H](c3cccc(c3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.5
|
| 5893 |
MAT-POS-fce787c2-7_2
|
|
C[C@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)[NH3+] |
−7.9
± 0.3
|
| 5894 |
EN300-54891_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@@H]5CO |
−7.9
± 0.3
|
| 5895 |
MAK-UNK-c749d764-25_4
|
|
COC(=O)N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@H]([C@@H]3O)C(F)F |
−7.9
± 0.3
|
| 5896 |
EN300-2983332_2_2_1 |
|
CC(C)[C@H]1CNC(=O)CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.3
|
| 5897 |
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 |
−7.9
± 0.4
|
| 5898 |
EN300-07752_2_4_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@H](C[C@H]5C(=O)N)O |
−7.9
± 0.4
|
| 5899 |
EN300-1387145_1_2_1 |
|
CS(=O)(=O)[C@H]1CCC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.7
|
| 5900 |
DAR-DIA-0d514e7d-21_1
|
|
C[C@H]1COc2c(cc(cc2N3CC[NH2+]CC3)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−7.9
± 0.2
|