Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
3901 |
EN300-247468_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC56COC6 |
−8.9
± 0.2
|
6.5
± 0.2
|
3902 |
EN300-160143_1_1
|
|
CN1CCCN(CC1=O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.2
|
6.5
± 0.1
|
3903 |
EN300-716082_1_1
|
|
Cn1c(c[cH+][nH]1)[C@@H](CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3904 |
ALF-EVA-5b152d2f-2
|
|
Cc1ccc2cncc(c2c1)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.89
± 0.06
|
6.48
± 0.04
|
3905 |
EN300-227044_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)(CO)C#N |
−8.9
± 0.2
|
6.5
± 0.2
|
3906 |
ALP-POS-d3acb8cc-4_1
|
|
C[C@@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.89
± 0.05
|
6.48
± 0.03
|
3907 |
EN300-02015_2_1
|
|
COCCNC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.9
± 0.4
|
6.5
± 0.3
|
3908 |
KAD-UNI-8a629cb0-16
|
|
CCN1CN(CC1=O)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3909 |
EN300-262389_1_1
|
|
C[C@]1(CC[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3910 |
EN300-98099_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cc(cs5)S(=O)(=O)N |
−8.9
± 0.4
|
6.5
± 0.3
|
3911 |
KAD-UNI-8a629cb0-19
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)c5ccnc6c5CC(=O)N6 |
−8.9
± 0.3
|
6.5
± 0.2
|
3912 |
EN300-316679_2_1
|
|
CCC[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3913 |
MIC-UNK-16ccb665-3
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C(F)F |
−8.9
± 0.3
|
6.5
± 0.2
|
3914 |
BEN-DND-f2e727cd-1
|
|
c1ccc2c(c1)cncc2NC(=O)N3CCOc4c3cc(cc4)Cl |
−8.9
± 0.2
|
6.5
± 0.2
|
3915 |
EN300-33601_1_2
|
|
CN1C[C@H](CC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3916 |
EN300-107435_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCCCS5(=O)=O |
−8.9
± 0.3
|
6.5
± 0.2
|
3917 |
EDJ-MED-28ec730d-3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC5CCOCC5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3918 |
EN300-07752_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5C[C@@H](C[C@@H]5C(=O)N)O |
−8.9
± 0.5
|
6.5
± 0.3
|
3919 |
ED_-GRI-5b13fbe2-47
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(C(=O)O)F |
−8.9
± 0.2
|
6.5
± 0.2
|
3920 |
EN300-249093_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCOC[C@@H]5CC(=O)N |
−8.9
± 0.3
|
6.5
± 0.2
|
3921 |
EN300-331828_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CO[C@@H]5COC[C@H]5O |
−8.9
± 0.3
|
6.5
± 0.2
|
3922 |
EN300-117414_1_2
|
|
C[C@H](CO)N(C)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.9
± 0.4
|
6.5
± 0.3
|
3923 |
EN300-204507_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)(CO)F |
−8.9
± 0.2
|
6.5
± 0.2
|
3924 |
EN300-248888_2_1
|
|
C[C@@](C=C)(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3925 |
EN300-7444533_4_4
|
|
C[C@H]1C[C@H](C(=O)O1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.4
|
6.5
± 0.3
|
3926 |
EN300-261859_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5C(=O)NSN5 |
−8.9
± 0.2
|
6.5
± 0.1
|
3927 |
RAL-THA-4aa06b95-3
|
|
CNC(=O)N1CCC(c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.9
± 0.3
|
6.5
± 0.2
|
3928 |
RAL-THA-1d44ff04-1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)OCc4[nH]ccn4 |
−8.9
± 0.4
|
6.5
± 0.3
|
3929 |
EN300-195756_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@@H]5CCC(=O)N5 |
−8.9
± 0.4
|
6.5
± 0.3
|
3930 |
EN300-257405_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@](C5)(CC#N)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3931 |
EDG-MED-ba1ac7b9-20
|
|
c1ccc2c(c1)cncc2NC(=O)C3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOCC5CC(F)F |
−8.9
± 0.2
|
6.5
± 0.1
|
3932 |
EN300-7427921_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)n6cnnc6 |
−8.9
± 0.3
|
6.5
± 0.2
|
3933 |
EN300-12440_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H]5CC(=O)N(C5)C6CC6 |
−8.9
± 0.3
|
6.5
± 0.2
|
3934 |
EN300-148421_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@]5(CCOC5)O |
−8.9
± 0.4
|
6.5
± 0.3
|
3935 |
EN300-6489289_3_2
|
|
CC1NNC2[N@H+]1[C@H](CC2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.9
± 0.3
|
6.5
± 0.2
|
3936 |
EN300-217526_4_1
|
|
CCn1c(c(nn1)C)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3937 |
EN300-7352736_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5C[C@@H]([C@@H](CO5)O)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3938 |
EN300-69312_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@@H](C5)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3939 |
EN300-1627945_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CO[C@@H]5CCCOC5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3940 |
EN300-49064_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5COC5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3941 |
EN300-172640_1_4
|
|
C[C@H]1[C@H](NC(=O)O1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3942 |
EN300-104746_1_1
|
|
CC[C@@](C)(C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.9
± 0.3
|
6.5
± 0.2
|
3943 |
EN300-1703015_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(=O)Nc5[nH]ccn5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3944 |
JOH-SUS-a69c159d-5_1
|
|
c1cc2c(cc1F)c(cnc2F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.86
± 0.06
|
6.46
± 0.05
|
3945 |
EN300-191495_2_1
|
|
CS(=O)(=O)C1(CC1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.4
|
6.5
± 0.3
|
3946 |
EN300-75209_2_1
|
|
C[C@@H](CS(=O)(=O)C)N(C)C(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.9
± 0.3
|
6.5
± 0.2
|
3947 |
EN300-649738_4_1
|
|
Cc1c(n(nn1)C)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3948 |
EN300-6335413_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H]5C(=O)NCCO |
−8.9
± 0.4
|
6.5
± 0.3
|
3949 |
MAT-POS-1f3f1a6f-1
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3ccc(c(c3)Cl)Cl)N |
−8.9
± 0.3
|
6.5
± 0.2
|
3950 |
EN300-244122_1_1
|
|
CC1(CN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−8.9
± 0.3
|
6.5
± 0.2
|
3951 |
EN300-7396882_2_1
|
|
CC1(CC(C1)O)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3952 |
EN300-6482296_4_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@@H]5CO[C@@H]6[C@H]5COC6 |
−8.9
± 0.4
|
6.5
± 0.3
|
3953 |
EN300-364992_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CC[C@H]5CC[C@H](O5)C(=O)N |
−8.9
± 0.3
|
6.5
± 0.2
|
3954 |
EN300-1704404_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CNC(=O)CC56CCC6 |
−8.9
± 0.3
|
6.5
± 0.2
|
3955 |
EN300-266736_1_1
|
|
Cc1c(nc[nH]1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.2
|
6.5
± 0.2
|
3956 |
EN300-21009_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCCO5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3957 |
EN300-761220_4_1
|
|
CC(=O)N1CSC[C@@H]1C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.5
± 0.2
|
3958 |
EN300-209532_2_1
|
|
CN(CCC(=O)N)C(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.9
± 0.3
|
6.4
± 0.2
|
3959 |
DAR-DIA-23e5a6a0-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4C[C@@H]5CC6([NH2+]5)COC6)Cl |
−8.9
± 0.4
|
6.4
± 0.3
|
3960 |
EN300-633533_2_1
|
|
CS(=O)(=O)[C@@H]1C[C@]1(COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C#N |
−8.9
± 0.3
|
6.4
± 0.2
|
3961 |
EN300-7459545_2_1
|
|
C[NH+](C)C[C@@](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C(F)(F)F)O |
−8.9
± 0.5
|
6.4
± 0.4
|
3962 |
EN300-304051_2_1
|
|
Cn1cc(nn1)CN(C)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.4
± 0.2
|
3963 |
EDG-MED-90036822-12
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)/C=C/CN5CCC5C(=O)N |
−8.9
± 0.2
|
6.4
± 0.1
|
3964 |
EN300-6503811_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)[C@H](Cc5cnc[nH]5)O |
−8.9
± 0.3
|
6.4
± 0.3
|
3965 |
ALP-POS-5bb456a5-4
|
|
Cn1c(nnn1)C2=CCN(CC2)C(=O)C[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.9
± 0.6
|
6.4
± 0.4
|
3966 |
JAG-UCB-706446eb-6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ccn[nH]5 |
−8.9
± 0.2
|
6.4
± 0.2
|
3967 |
EN300-84476_1_1
|
|
C[C@@H](CNC(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.9
± 0.3
|
6.4
± 0.2
|
3968 |
JOH-UNI-3fc3434e-1
|
|
C#CC(=O)c1cccc2c1c(cnc2)NC(=O)Cc3cccc(c3)Cl |
−8.8
± 0.3
|
6.4
± 0.2
|
3969 |
EN300-77092_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC5OCCO5 |
−8.8
± 0.2
|
6.4
± 0.2
|
3970 |
EN300-82616_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CCCNC5=O |
−8.8
± 0.2
|
6.4
± 0.2
|
3971 |
MAT-POS-b3e365b9-1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.85
± 0.03
|
6.45
± 0.02
|
3972 |
ADA-UCB-dc2b944c-4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]34C[C@H]3COc5c4cc(cc5)Cl |
−8.8
± 0.3
|
6.4
± 0.2
|
3973 |
DAR-DIA-076fb6ea-1
|
|
C=CC(=O)N(c1cncc2c1cccc2)C(=O)Cc3cccc(c3)Cl |
−8.8
± 0.4
|
6.4
± 0.3
|
3974 |
EN300-10397_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)CNC(=O)N |
−8.8
± 0.2
|
6.4
± 0.2
|
3975 |
EN300-76382_3_1
|
|
CCNC(=O)NC(C)(C)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.3
|
3976 |
EN300-7448078_1_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6(CC5)[C@@H](C[C@H]6O)O |
−8.8
± 0.3
|
6.4
± 0.3
|
3977 |
EN300-253462_1_1
|
|
CN(C)C(=O)[C@@H]1C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
3978 |
EN300-122340_4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCNC(=O)C5(CCSCC5)O |
−8.8
± 0.4
|
6.4
± 0.3
|
3979 |
EN300-36855_1_1
|
|
CN(CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)c5cnccn5 |
−8.8
± 0.2
|
6.4
± 0.1
|
3980 |
EN300-7439985_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC6(CC5C6)CO |
−8.8
± 0.2
|
6.4
± 0.2
|
3981 |
VLA-UCB-05e51b3f-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4O[C@H]5CC(=O)N5)Cl)CCC6CCCCC6 |
−8.8
± 0.5
|
6.4
± 0.4
|
3982 |
LON-WEI-5e7d1b3e-58
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)Nc3nc4ccc(cc4s3)OC |
−8.8
± 0.5
|
6.4
± 0.4
|
3983 |
EN300-260816_2_2
|
|
CN1CC[C@H](C1=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
3984 |
EN300-33398_3_1
|
|
CC(C)N1C[C@@H](CC1=O)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
3985 |
EN300-1707879_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CNC(=O)C[C@]56CCOC6 |
−8.8
± 0.3
|
6.4
± 0.2
|
3986 |
ADA-UCB-dc2b944c-3
|
|
c1ccc2c(c1)cncc2NC(=O)N(CCC3CCCCC3)c4cc(ccc4O)Cl |
−8.8
± 0.5
|
6.4
± 0.4
|
3987 |
EN300-103284_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NC5(CCC5)CC(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
3988 |
EN300-6739235_1_1
|
|
C[NH+](C)C1CC(C1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
3989 |
EN300-249421_3_1
|
|
C[C@@H]([C@@H]1CCC(=O)N1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
3990 |
EN300-07879_2_1
|
|
CSCC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
3991 |
EDJ-MED-40433386-10
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5(CC5)CN |
−8.8
± 0.4
|
6.4
± 0.3
|
3992 |
MAT-POS-bb423b95-8
|
|
c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2ccc(c3)O |
−8.8
± 0.2
|
6.4
± 0.2
|
3993 |
EN300-7457160_2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COC[C@@H]5C[C@H](ON5)CC6(COC6)O |
−8.8
± 0.3
|
6.4
± 0.2
|
3994 |
EN300-302290_1_1
|
|
CS(=O)(=O)N1CC(C1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
3995 |
EN300-39405_3_1
|
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)S(=O)(=O)C |
−8.8
± 0.3
|
6.4
± 0.2
|
3996 |
EN300-118117_1_1
|
|
Cn1c(cccc1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.2
|
3997 |
EN300-178876_2_2
|
|
C[C@]1(CCCNC1=O)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
3998 |
EN300-202757_2_1
|
|
C[C@@H](CC(=O)N)C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.2
|
3999 |
RAL-THA-8416115c-8
|
|
c1ccc2c(c1)cncc2NC(=O)C3CCN(c4c3cc(cc4)Cl)CC(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
4000 |
EN300-1253092_1_2
|
|
CN([C@H]1CCC(=O)NC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|