Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
401 |
EN300-216673_3_1
|
|
Cn1c(cnn1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.2
|
402 |
EN300-105267_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)Nc5cnccn5 |
−11.5
± 0.3
|
8.4
± 0.2
|
403 |
EN300-211777_3_1
|
|
CC(=O)N1CCC[C@@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.3
|
404 |
EN300-7444950_3_1
|
|
COc1cc(ncn1)CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.2
|
405 |
EN300-1262608_1_1
|
|
CCNC(=O)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.5
± 0.2
|
8.4
± 0.2
|
406 |
EN300-243828_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c[nH]ncc5=O |
−11.5
± 0.3
|
8.4
± 0.2
|
407 |
EN300-7444533_1_2
|
|
C[C@H]1C[C@@H](C(=O)O1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.2
|
408 |
MAK-UNK-c749d764-29
|
|
c1ccc2c(c1)cncc2N(C(=O)CC3CCCC(C3O)C(F)F)C(=O)ON |
−11.5
± 0.2
|
8.4
± 0.2
|
409 |
EN300-251867_1_1
|
|
COCCn1cc(nn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.2
|
8.4
± 0.2
|
410 |
EN300-214172_1_1
|
|
Cn1cnc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.2
|
8.4
± 0.1
|
411 |
EN300-61694_1_1
|
|
Cn1ncc(n1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.2
|
8.4
± 0.1
|
412 |
EN300-6505003_1_2
|
|
C[C@H]1CC[C@@H](C(=O)N1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.2
|
413 |
EN300-220194_3_2
|
|
C[C@H]([C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)OC |
−11.5
± 0.3
|
8.4
± 0.2
|
414 |
EN300-761220_1_1
|
|
CC(=O)N1CSC[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.2
|
415 |
EN300-28894_1_1
|
|
Cc1c(nn(c(=O)c1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C)C |
−11.5
± 0.3
|
8.4
± 0.2
|
416 |
EN300-203293_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@H]5CNC(=O)O5 |
−11.5
± 0.3
|
8.4
± 0.2
|
417 |
EN300-143449_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCCN(=O)=O |
−11.5
± 0.3
|
8.4
± 0.2
|
418 |
EN300-6497444_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnn6c5OC[C@H](C6)O |
−11.5
± 0.2
|
8.4
± 0.2
|
419 |
EN300-264301_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H]5CCC(=O)N5 |
−11.5
± 0.2
|
8.4
± 0.2
|
420 |
EN300-6745453_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5Cc6nncn6C5 |
−11.5
± 0.2
|
8.4
± 0.2
|
421 |
EN300-1072199_3_1
|
|
CO[C@@]1(CCCOC1)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.3
|
8.4
± 0.3
|
422 |
EN300-313062_1_4
|
|
CC(=O)N1C[C@H]2C[C@]2(C1)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−11.5
± 0.3
|
8.4
± 0.2
|
423 |
EN300-178293_3_1
|
|
C[NH+]1CCN(CC1)C(=O)CCOCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.4
|
8.4
± 0.3
|
424 |
EN300-77359_3_1
|
|
C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)OCCOC |
−11.5
± 0.3
|
8.3
± 0.2
|
425 |
EN300-2008102_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5CN6C[C@@H](O5)CCC6=O |
−11.5
± 0.3
|
8.3
± 0.2
|
426 |
EN300-7456948_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5cccnn5 |
−11.5
± 0.2
|
8.3
± 0.2
|
427 |
EN300-103638_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CN5CCCOC5=O |
−11.5
± 0.3
|
8.3
± 0.2
|
428 |
EN300-6744028_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H]6C[C@@H]5[C@@H]([C@@H]6O)O |
−11.5
± 0.3
|
8.3
± 0.2
|
429 |
EN300-1644723_1_8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5[C@H]6[C@H]5COCC6 |
−11.5
± 0.2
|
8.3
± 0.1
|
430 |
EN300-2908024_3_1
|
|
CC[C@@](C)(C(=O)N)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.5
± 0.3
|
8.3
± 0.2
|
431 |
EN300-201551_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5COCC[N@@H+]5CC(F)(F)F |
−11.5
± 0.3
|
8.3
± 0.2
|
432 |
EN300-6238494_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)[C@H]5COCCO5 |
−11.5
± 0.3
|
8.3
± 0.2
|
433 |
VLA-UCB-34f3ed0c-3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)NCc5cc[nH]n5 |
−11.5
± 0.2
|
8.3
± 0.2
|
434 |
EN300-6738887_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5[C@@H]6CC[C@H]5[C@H](CC[C@@H]6O)O |
−11.5
± 0.3
|
8.3
± 0.2
|
435 |
EN300-6488240_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5nncs5 |
−11.5
± 0.2
|
8.3
± 0.2
|
436 |
EN300-85473_1_1
|
|
Cc1c(nnn1C)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.5
± 0.2
|
8.3
± 0.2
|
437 |
EN300-872798_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5c(nnn5)C6CC6 |
−11.5
± 0.3
|
8.3
± 0.2
|
438 |
MAT-POS-de59a476-3
|
|
c1ccc2c(c1)cncc2NC(=O)C(c3ccc(c(c3)Cl)Cl)OCCN4CCOCC4=O |
−11.5
± 0.4
|
8.3
± 0.3
|
439 |
EN300-6764836_1_6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@@H]6[C@@H]([C@H]([C@H]5O6)O)O |
−11.4
± 0.3
|
8.3
± 0.2
|
440 |
EN300-6478631_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCCc6n5cnn6 |
−11.4
± 0.2
|
8.3
± 0.2
|
441 |
EN300-97055_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5c(=O)[nH]ccn5 |
−11.4
± 0.2
|
8.3
± 0.2
|
442 |
EN300-222969_3_2
|
|
CN1C[C@H](OC1=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.3
|
8.3
± 0.2
|
443 |
EN300-1601684_1_1
|
|
CC1([C@@H](OCCO1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)C |
−11.4
± 0.3
|
8.3
± 0.2
|
444 |
EN300-56202_3_2
|
|
CC(=O)N1CSC[C@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.3
|
8.3
± 0.2
|
445 |
EN300-1627945_3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CO[C@H]5CCCOC5 |
−11.4
± 0.2
|
8.3
± 0.2
|
446 |
EN300-103722_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnn6c5OCCC6 |
−11.4
± 0.2
|
8.3
± 0.2
|
447 |
EN300-20980_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)Cn5cnnn5 |
−11.4
± 0.3
|
8.3
± 0.2
|
448 |
EN300-297561_1_2
|
|
CC(C)[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5cnnn5 |
−11.4
± 0.3
|
8.3
± 0.2
|
449 |
EN300-2690393_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(cnc5)n6cnnn6 |
−11.4
± 0.2
|
8.3
± 0.2
|
450 |
EN300-98018_3_1
|
|
CC(=O)N1CC[C@@](C1)(C)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.4
|
8.3
± 0.3
|
451 |
EN300-21009_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCCO5 |
−11.4
± 0.2
|
8.3
± 0.2
|
452 |
PET-UNK-a17c93d1-1
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)OCC4CCCCC4 |
−11.4
± 0.4
|
8.3
± 0.3
|
453 |
EN300-1709410_1_4
|
|
C[C@H]1C[C@H](N1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CO |
−11.4
± 0.3
|
8.3
± 0.2
|
454 |
EN300-208236_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCCc6c5n[nH]n6 |
−11.4
± 0.3
|
8.3
± 0.2
|
455 |
EN300-103720_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc6n(n5)CCCO6 |
−11.4
± 0.2
|
8.3
± 0.2
|
456 |
EDG-MED-90036822-72
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc(n[nH]5)F |
−11.4
± 0.2
|
8.3
± 0.1
|
457 |
EN300-7473378_3_1
|
|
C[NH+]1CCC(CC1)(C#N)C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.4
|
8.3
± 0.3
|
458 |
EDG-MED-90036822-34
|
|
COCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.4
± 0.2
|
8.3
± 0.1
|
459 |
EN300-6764836_1_8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@@H]6[C@H]([C@H]([C@H]5O6)O)O |
−11.4
± 0.3
|
8.3
± 0.2
|
460 |
EN300-217107_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CC[C@@H]5C(=O)N |
−11.4
± 0.3
|
8.3
± 0.2
|
461 |
EN300-249764_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H](C5CCC5)O |
−11.4
± 0.2
|
8.3
± 0.2
|
462 |
EN300-181492_3_1
|
|
C=C[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−11.4
± 0.3
|
8.3
± 0.2
|
463 |
EN300-6729572_1_6
|
|
C[C@H]([C@@H]1C[C@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−11.4
± 0.2
|
8.3
± 0.2
|
464 |
EN300-108236_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5cc(nn5)CO |
−11.4
± 0.3
|
8.3
± 0.2
|
465 |
EN300-6729572_3_7
|
|
C[C@@H]([C@H]1C[C@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−11.4
± 0.3
|
8.3
± 0.2
|
466 |
EN300-10170_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)[C@@H](CO)NC(=O)N |
−11.4
± 0.3
|
8.3
± 0.2
|
467 |
EDJ-MED-d203f206-31
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N(CC(=O)N)C5CCOCC5 |
−11.4
± 0.3
|
8.3
± 0.2
|
468 |
EN300-7432302_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@]56CC[C@H](C5)[C@@H]([C@@H]6O)O |
−11.4
± 0.3
|
8.3
± 0.3
|
469 |
EN300-1915260_4_2
|
|
COC[C@H](COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−11.4
± 0.5
|
8.3
± 0.3
|
470 |
EN300-54891_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@@H]5CO |
−11.4
± 0.3
|
8.3
± 0.2
|
471 |
EN300-1072972_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C[C@@H]5CCOC5=O |
−11.4
± 0.4
|
8.3
± 0.3
|
472 |
EN300-1600363_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C[C@H]5C#N |
−11.4
± 0.2
|
8.3
± 0.1
|
473 |
EN300-157527_1_1
|
|
Cn1c(c(cn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)n6cnnc6 |
−11.4
± 0.3
|
8.3
± 0.2
|
474 |
EN300-105267_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)Nc5cnccn5 |
−11.4
± 0.2
|
8.3
± 0.2
|
475 |
EN300-1273172_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnc(cn5)C(=O)N |
−11.4
± 0.3
|
8.3
± 0.2
|
476 |
EDG-MED-90036822-79
|
|
Cc1c(c(n[nH]1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−11.4
± 0.3
|
8.3
± 0.2
|
477 |
EDG-MED-90036822-98
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C5CCCN5CC(F)F |
−11.4
± 0.2
|
8.3
± 0.2
|
478 |
EN300-5253939_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5COC(=O)O5 |
−11.4
± 0.2
|
8.3
± 0.2
|
479 |
EN300-310173_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5[C@H](CCO5)Cn6ccnc6 |
−11.4
± 0.4
|
8.3
± 0.3
|
480 |
EN300-6745081_1_1
|
|
C[C@@]1(CCCCNC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.3
|
8.3
± 0.2
|
481 |
EN300-143564_1_1
|
|
CN\1C(=O)CS/C1=C\C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.2
|
8.3
± 0.2
|
482 |
EN300-101291_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cn(c(=O)[nH]c5=O)CCO |
−11.4
± 0.4
|
8.3
± 0.3
|
483 |
EN300-20668_3_1
|
|
COC(=O)CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.4
± 0.3
|
8.3
± 0.2
|
484 |
EN300-06030_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(cc5)n6cnnn6 |
−11.4
± 0.3
|
8.3
± 0.2
|
485 |
EN300-6526669_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cnn6c5C(=O)NCC6 |
−11.4
± 0.3
|
8.3
± 0.2
|
486 |
EDG-MED-90036822-91
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(c5cccc(c5)F)N |
−11.4
± 0.2
|
8.3
± 0.2
|
487 |
EN300-260152_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cc5cnns5 |
−11.4
± 0.2
|
8.3
± 0.2
|
488 |
EN300-102487_1_1
|
|
Cn1c(=O)c(c[nH]c1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.4
± 0.3
|
8.3
± 0.2
|
489 |
EN300-174603_3_1
|
|
CN(C(=O)CCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)OC |
−11.4
± 0.3
|
8.3
± 0.2
|
490 |
EN300-44821_1_1
|
|
C=CCOCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−11.4
± 0.2
|
8.3
± 0.1
|
491 |
EN300-6744028_1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5C[C@H]6C[C@@H]5[C@H]([C@@H]6O)O |
−11.4
± 0.3
|
8.3
± 0.2
|
492 |
EN300-80230_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ncccn5 |
−11.3
± 0.1
|
8.27
± 0.10
|
493 |
EN300-365398_2_1
|
|
Cn1c(nnn1)CCOC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.3
± 0.3
|
8.3
± 0.2
|
494 |
EDJ-MED-6864a934-7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5cc6c(nc5)n[nH]n6 |
−11.3
± 0.2
|
8.3
± 0.2
|
495 |
EN300-1600517_3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOC[C@@H](CO)F |
−11.3
± 0.3
|
8.3
± 0.2
|
496 |
EN300-94945_1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]5CCNC5=O |
−11.3
± 0.2
|
8.3
± 0.2
|
497 |
EN300-4293814_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CS(=O)(=O)CCO |
−11.3
± 0.5
|
8.3
± 0.4
|
498 |
EN300-213358_1_1
|
|
Cn1c(ncn1)COCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.3
± 0.2
|
8.3
± 0.2
|
499 |
EN300-97697_1_1
|
|
CN(C1CC(C1)O)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−11.3
± 0.3
|
8.3
± 0.2
|
500 |
EN300-7463171_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCS(=O)(=O)CCO |
−11.3
± 0.4
|
8.3
± 0.3
|