| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 1701 |
MAK-UNK-ffc90da7-3_2
|
|
CC(C)OC[C@H](c1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3)Cl)[NH2+]C |
−7.2
± 0.1
|
| 1702 |
MAK-UNK-c749d764-25_6
|
|
COC(=O)N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F |
−7.2
± 0.4
|
| 1703 |
EDJ-MED-1b5395f9-5_2
|
|
CS(=O)(=O)[N@]1Cc2cc(c(cc2[C@@H](C1)C(=O)Nc3cncc4c3cc(cc4)F)Cl)Cl |
−7.2
± 0.2
|
| 1704 |
LON-WEI-5e7d1b3e-50_2
|
|
CCCC[N@H+](CCNC(=O)Nc1cn(c(=O)c2c1cccc2)C)Cc3ccco3 |
−7.2
± 0.5
|
| 1705 |
ERI-UCB-ce40166b-2_1
|
|
c1ccc2c(c1)cncc2CC(=O)Nc3cccc(c3)O[C@@H]4CCC(=O)N4 |
−7.2
± 0.1
|
| 1706 |
JAG-UCB-706446eb-4_1
|
|
CCOC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.2
± 0.3
|
| 1707 |
EDJ-MED-ee07cf00-7_2
|
|
Cc1c(c(=O)ccn1CC(=O)N[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4)[O-] |
−7.2
± 0.2
|
| 1708 |
EDG-MED-90036822-38_2
|
|
C[C@H](CNCC(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(F)F)O |
−7.2
± 0.4
|
| 1709 |
EDJ-MED-923a35c2-4_1
|
|
C[C@@]1(C[N@@](Cc2c1cc(c(c2)F)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cc(cc4)F |
−7.16
± 0.08
|
| 1710 |
EDG-MED-ba1ac7b9-13_3
|
|
C[N@@H+]1C[C@@H]2C[C@H]1CN2C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.16
± 0.10
|
| 1711 |
EDG-MED-90036822-52_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(CNCCCO)(F)F |
−7.2
± 0.4
|
| 1712 |
EDJ-MED-841e0cf0-2_1
|
|
CO[C@@]1(C[N@@](Cc2c1cc(c(c2)F)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cccc4 |
−7.2
± 0.2
|
| 1713 |
MAT-POS-e9e99895-6_1
|
|
C[C@@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)CN4CCN(C4=O)C5CC5 |
−7.16
± 0.09
|
| 1714 |
MAT-POS-4223bc15-8_6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@H]5CCOC5 |
−7.16
± 0.09
|
| 1715 |
PET-UNK-7be94445-1_1
|
|
c1ccc2c(c1)cncc2N3CCCN(C3=O)c4cccc(c4)Cl |
−7.2
± 0.1
|
| 1716 |
EDG-MED-971238d3-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC[NH3+] |
−7.2
± 0.3
|
| 1717 |
LON-WEI-5e7d1b3e-35_2
|
|
Cc1ccc(cc1)C[N@H+]2CC[C@@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−7.2
± 0.3
|
| 1718 |
MAT-POS-e9e99895-2_3
|
|
CC(C)[N@@H+]1CCO[C@H](C1)C(=O)N[C@@](C)(c2ccc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.15
± 0.09
|
| 1719 |
MIC-UNK-f792ef5d-1_1
|
|
C[N@@H+]1C[C@H]2COc3ccc(cc3[C@]2(C1)C(=O)Nc4cncc5c4cccc5)Cl |
−7.2
± 0.3
|
| 1720 |
ALP-POS-966f8da6-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5cnc[nH]5 |
−7.2
± 0.3
|
| 1721 |
ALP-POS-67d5babe-1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC[N@H+]5CC[C@@H]6CS(=O)(=O)C[C@@H]6C5 |
−7.2
± 0.2
|
| 1722 |
ED_-GRI-5b13fbe2-74_4
|
|
C[N@H+]1CCO[C@H](C1)c2nccc(n2)CO[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.2
± 0.5
|
| 1723 |
VLA-UCB-34f3ed0c-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)NCc5ccn[nH]5 |
−7.1
± 0.3
|
| 1724 |
MAT-POS-3b97339c-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]c5S(=O)(=O)N |
−7.1
± 0.2
|
| 1725 |
PET-UNK-5d7c542f-1_1
|
|
CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3ccc(c4)F |
−7.1
± 0.1
|
| 1726 |
DAR-DIA-076fb6ea-8_1
|
|
C=C=CC(=O)N(c1cncc2c1cccc2)C(=O)Cc3cccc(c3)Cl |
−7.1
± 0.2
|
| 1727 |
MAT-POS-4223bc15-2_2
|
|
CN(C)S(=O)(=O)[N@]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−7.14
± 0.10
|
| 1728 |
KAD-UNI-877d7bed-18_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4OCCS(=O)(=O)CCCO)Cl |
−7.1
± 0.1
|
| 1729 |
ALP-POS-347519b5-1_30
|
|
CS(=O)(=O)[N@]1C[C@@H]2[C@H]3CC[C@H](C3)[C@H]2[C@@H](C1)C(=O)Nc4cncc5c4cccc5 |
−7.1
± 0.1
|
| 1730 |
MIC-UNK-25b9c114-1_1
|
|
CS(=O)(=O)NC[C@@H]1CN(C(=O)CN1C(=O)c2cncc3c2cccc3)c4cccc(c4)Cl |
−7.1
± 0.3
|
| 1731 |
JAG-UCB-f37eaa14-8_2
|
|
c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@](c5c4cc(cc5)Cl)CCn6ccnc6 |
−7.1
± 0.2
|
| 1732 |
MAT-POS-4223bc15-34_2
|
|
Cn1ccnc1[N@]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cccc5)Cl |
−7.1
± 0.1
|
| 1733 |
EDJ-MED-15e90dfc-7_1
|
|
CS(=O)(=O)CCNC[C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.2
|
| 1734 |
PET-UNK-372a2f82-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)Cc4ccn[nH]4 |
−7.14
± 0.09
|
| 1735 |
RAL-THA-05e671eb-16_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4Cl)Cl |
−7.1
± 0.3
|
| 1736 |
MIC-UNK-cdc2493e-12_1
|
|
C[NH+](C)[C@@H]1CC[C@@H](C1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.3
|
| 1737 |
MAT-POS-4223bc15-14_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)CC5C[NH2+]C5 |
−7.1
± 0.2
|
| 1738 |
RAL-THA-8416115c-14_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5cn[nH]n5 |
−7.1
± 0.3
|
| 1739 |
DAR-DIA-0d514e7d-31_16
|
|
C[C@H]1CCO[C@H]2C=CC(=C[C@H]2[C@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−7.1
± 0.3
|
| 1740 |
VLA-UNK-83c3754c-2_1
|
|
CN1C(=O)N(C(=O)[C@@]12COc3c2cc(cc3)Cl)c4cncc5c4cccc5 |
−7.1
± 0.2
|
| 1741 |
MIC-UNK-bcd487e9-1_1
|
|
c1ccc(cc1)CN(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.3
|
| 1742 |
WIL-UCB-7ba4ac3a-3_1
|
|
c1ccc2c(c1)cncc2NS(=O)(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.1
± 0.3
|
| 1743 |
EDG-MED-10fcb19e-1_2
|
|
CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cc(cc4)NS(=O)(=O)C |
−7.1
± 0.3
|
| 1744 |
MIC-UNK-644c43c7-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)CCNC(C(F)(F)F)C(F)(F)F |
−7.1
± 0.4
|
| 1745 |
ALP-UNI-dbbfd3db-13_1
|
|
Cn1cc(cn1)C2=NO[C@@H](C2)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.13
± 0.08
|
| 1746 |
MAT-POS-4223bc15-1_2
|
|
CNS(=O)(=O)[N@]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−7.13
± 0.09
|
| 1747 |
ALP-POS-347519b5-2_37
|
|
CO[C@@]1(C[N@@](C[C@H]2[C@@H]1[C@@H]3CC[C@H]2C3)S(=O)(=O)C)C(=O)Nc4cncc5c4cccc5 |
−7.1
± 0.1
|
| 1748 |
EDJ-MED-c82a5324-1_7
|
|
CNC(=O)[C@@H](CO)[N@H+]1Cc2ccc(cc2[C@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−7.1
± 0.2
|
| 1749 |
LON-WEI-5e7d1b3e-15_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)NCCCN3CCCC3=O |
−7.1
± 0.3
|
| 1750 |
MAK-UNK-83e0a0b4-1_1
|
|
CCCCc1ccc2c(c1)[C@@H](CCO2)C(=O)N(CCNC3C[NH2+]C3)c4cncc5c4ccc(c5)CN6CC[NH2+]CC6 |
−7.1
± 0.4
|
| 1751 |
EDJ-MED-37aac4bd-3_1
|
|
COC[C@@]1(CCOc2c1cc(cc2F)F)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.2
|
| 1752 |
EDG-MED-ba1ac7b9-4_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)[N@H+]6CC[C@@H](C6)O |
−7.1
± 0.3
|
| 1753 |
ALP-POS-f13221e1-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)CCc3cccc(c3)Cl |
−7.12
± 0.09
|
| 1754 |
ALP-POS-5bb456a5-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)c6n[n-]nn6 |
−7.1
± 0.5
|
| 1755 |
EDJ-MED-139368ae-1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cccc4)S(=O)(=O)N5CCOCC5 |
−7.1
± 0.2
|
| 1756 |
MAK-UNK-c749d764-29_6
|
|
c1ccc2c(c1)cncc2N(C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F)C(=O)ON |
−7.1
± 0.4
|
| 1757 |
LON-WEI-5e7d1b3e-23_1
|
|
Cn1cc(c2ccccc2c1=O)NC(=O)Nc3cccc(c3)C(F)(F)F |
−7.1
± 0.3
|
| 1758 |
EDJ-MED-f893e2a1-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)C[NH2+]C[C@]5(CCSC5)O |
−7.1
± 0.2
|
| 1759 |
MAK-UNK-c749d764-28_7
|
|
c1ccc2c(c1)cncc2N(C=O)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−7.1
± 0.6
|
| 1760 |
ALF-EVA-07677224-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)c5ccc(s5)F |
−7.1
± 0.2
|
| 1761 |
MAT-POS-fb82b63d-3_3
|
|
C[N@@H+]1CCc2ccc(cc2[C@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−7.11
± 0.08
|
| 1762 |
JOH-UNI-3fc3434e-10_1
|
|
CN(c1c2ccccc2cnc1CC(F)(F)F)C(=O)Cc3cccc(c3)Cl |
−7.1
± 0.5
|
| 1763 |
VLA-UCB-05e51b3f-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4O[C@@H]5CC(=O)N5)Cl |
−7.1
± 0.2
|
| 1764 |
ALP-UNI-b33a865d-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5cnc[nH]5 |
−7.11
± 0.10
|
| 1765 |
MIC-UNK-0a05c952-4_6
|
|
c1ccc2c(c1)cncc2N3[C@H](CC[C@@H](C3=O)c4ccc(c(c4)Cl)Cl)[C@H]5CO5 |
−7.1
± 0.2
|
| 1766 |
EDJ-MED-f893e2a1-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)C[NH2+]C[C@]5(CCSC5)O |
−7.1
± 0.2
|
| 1767 |
EDJ-MED-611d11e7-6_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCOc4c3cc(c(c4)F)Cl |
−7.11
± 0.10
|
| 1768 |
MAT-POS-b5746674-35_2
|
|
Cn1cc(c2ccccc2c1=O)NC(=O)NCC[N@H+](Cc3ccco3)C4CCCC4 |
−7.1
± 0.2
|
| 1769 |
VLA-UNK-9a7dc93f-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(c(c4F)F)C#N |
−7.1
± 0.2
|
| 1770 |
MIC-UNK-cdc2493e-12_3
|
|
C[NH+](C)[C@@H]1CC[C@H](C1)N(c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.3
|
| 1771 |
MAT-POS-281d2ee9-1_2
|
|
C[C@H](c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3)C(=O)N |
−7.10
± 0.10
|
| 1772 |
LON-WEI-9739a092-4_2
|
|
CCN(Cc1ccc(cc1)F)c2cc(cc(c2)Cl)CC(=O)Nc3cncc4c3cccc4 |
−7.10
± 0.08
|
| 1773 |
ED_-GRI-5b13fbe2-17_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H](c5cn(nn5)CC6CC6)[NH3+] |
−7.1
± 0.3
|
| 1774 |
MIC-UNK-5a93dd5f-8_2
|
|
C[NH+](C)C1CC[NH+](CC1)[C@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.3
|
| 1775 |
MAT-POS-3b92565d-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)O[C@@H]4CC(=O)N4 |
−7.1
± 0.3
|
| 1776 |
RAL-THA-e002e396-5_2
|
|
CNS(=O)(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.2
|
| 1777 |
DAR-DIA-0f2f46c9-4_3
|
|
CS(=O)(=O)[N@@]1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.3
|
| 1778 |
MIC-UNK-5a93dd5f-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)[NH+]4C[C@H]5CCC[C@H]5C4 |
−7.1
± 0.3
|
| 1779 |
MAT-POS-61f37a1a-2_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@@H]5CCC[C@H]5O |
−7.10
± 0.09
|
| 1780 |
MAT-POS-24589f88-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@@H](O5)C(=O)N6CCCC6 |
−7.10
± 0.09
|
| 1781 |
EDJ-MED-424a8a89-2_1
|
|
CC(C)[NH2+]C[C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.1
± 0.1
|
| 1782 |
PET-UNK-c5865d42-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C([C@@H]4CCN4)(F)F |
−7.1
± 0.3
|
| 1783 |
ALP-POS-347519b5-2_35
|
|
CO[C@@]1(C[N@](C[C@@H]2[C@@H]1[C@@H]3CC[C@H]2C3)S(=O)(=O)C)C(=O)Nc4cncc5c4cccc5 |
−7.1
± 0.2
|
| 1784 |
EDJ-MED-8c98ee63-1_1
|
|
COCCC[NH2+]C[C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.10
± 0.06
|
| 1785 |
MAT-POS-a3f7f96a-7_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)C[NH2+]Cc5cnn(c5)[C@H]6CCS(=O)(=O)C6 |
−7.1
± 0.2
|
| 1786 |
ERI-UCB-ce40166b-1_1
|
|
c1ccc2c(c1)cncc2CC(=O)Nc3cccc(c3)O[C@@H]4CC(=O)N4 |
−7.1
± 0.2
|
| 1787 |
MAK-UNK-c749d764-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@H]3CCC[C@H]([C@@H]3O)C4CC4 |
−7.1
± 0.3
|
| 1788 |
BEN-BAS-c2bc0d80-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CC=Nc4c3[nH]c(cc4=O)Cl |
−7.1
± 0.3
|
| 1789 |
MAT-POS-9db1e783-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CO |
−7.09
± 0.09
|
| 1790 |
MIC-UNK-9582b2c5-2_8
|
|
CC(=O)N1CC[C@H]2[C@H](C1)C[C@H](C(=O)N2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−7.1
± 0.4
|
| 1791 |
ALP-POS-67d5babe-1_6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC[N@@H+]5CC[C@H]6CS(=O)(=O)C[C@@H]6C5 |
−7.1
± 0.2
|
| 1792 |
MAK-UNK-c749d764-31_3
|
|
CC/C=C(/c1cncc2c1cccc2)\C(=O)C[C@@H]3CCC[C@H]([C@@H]3O)C(F)F |
−7.1
± 0.3
|
| 1793 |
VLA-UNK-9a7dc93f-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(c(c(c3)F)F)C#N |
−7.1
± 0.4
|
| 1794 |
ALF-EVA-5b152d2f-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCCOc4c3cc(cc4)Cl |
−7.1
± 0.5
|
| 1795 |
MAT-POS-e9e99895-10_2
|
|
C[C@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)C[NH3+] |
−7.08
± 0.10
|
| 1796 |
MAT-POS-e9e99895-12_2
|
|
C[C@](c1ccc(c(c1)Cl)Cl)(C(=O)Nc2cncc3c2cccc3)NC(=O)CC[NH+](C)C |
−7.1
± 0.4
|
| 1797 |
JOH-SUS-a69c159d-3_1
|
|
c1ccc2c(c1)c(cnc2C(F)F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.1
± 0.4
|
| 1798 |
DAR-DIA-ecdbc7dd-10_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCNc4c3cc(cc4)Cl)C[NH+]5CCOCC5 |
−7.08
± 0.08
|
| 1799 |
RAL-THA-6e4c80cf-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CN(Cc4c3cc(cc4)Cl)C(=O)OCc5ccccn5 |
−7.08
± 0.09
|
| 1800 |
MAT-POS-e9e99895-8_3
|
|
Cc1nc2n(n1)C[C@@H](CC2)C(=O)N[C@](C)(c3ccc(c(c3)Cl)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.08
± 0.09
|