| Rank |
Compound |
SMILES |
ΔG / kcal M-1 |
pIC50 |
| 601 |
ADA-UCB-dc2b944c-16
|
|
CC1(C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4)C |
−8.9
± 0.1
|
6.45
± 0.08
|
| 602 |
EN300-203306_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)(C(=O)N)O |
−8.9
± 0.4
|
6.5
± 0.3
|
| 603 |
EN300-48902_2
|
|
CNC(=O)C1CCCN1C(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.9
± 0.3
|
6.4
± 0.2
|
| 604 |
EN300-120586_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NCC(F)F |
−8.8
± 0.3
|
6.4
± 0.2
|
| 605 |
EN300-103187_2
|
|
CCOCCNC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.3
|
| 606 |
EN300-7435544_1
|
|
CC(C)(C1CN(CCO1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.3
|
6.4
± 0.2
|
| 607 |
EN300-33553_1
|
|
Cc1c(c(=O)[nH]cn1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 608 |
EN300-7463171_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCS(=O)(=O)CCO |
−8.8
± 0.7
|
6.4
± 0.5
|
| 609 |
EN300-343103_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5[nH]c(=O)c6c(n5)CCOC6 |
−8.8
± 0.2
|
6.4
± 0.2
|
| 610 |
EN300-14458_2
|
|
CC(C(=O)N(C)C)OC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 611 |
EN300-7355737_1
|
|
Cn1cc(c(n1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)N |
−8.8
± 0.3
|
6.4
± 0.2
|
| 612 |
EN300-1706036_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC5C(=O)NCCO5 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 613 |
EN300-91905_1
|
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.2
|
6.4
± 0.2
|
| 614 |
EN300-211482_4
|
|
CC(C(=O)NC)OCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
| 615 |
EN300-203293_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC5CNC(=O)O5 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 616 |
EN300-190283_3
|
|
Cn1cncc1C(C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.5
|
6.4
± 0.4
|
| 617 |
EN300-245036_2
|
|
C[C@H]1[C@@H](CCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.3
|
6.4
± 0.2
|
| 618 |
EN300-25735_1
|
|
Cc1c(c(=O)[nH]c(=O)[nH]1)CCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 619 |
EN300-11300_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCc5cc(=O)[nH]c(=O)[nH]5 |
−8.8
± 0.4
|
6.4
± 0.3
|
| 620 |
EN300-45485_3
|
|
CS(=O)(=O)NCCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.4
|
6.4
± 0.3
|
| 621 |
EN300-48902_1
|
|
CNC(=O)C1CCCN1C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
6.4
± 0.1
|
| 622 |
EN300-1911992_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(C5CCOC5)O |
−8.8
± 0.2
|
6.4
± 0.2
|
| 623 |
EN300-223741_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)C5(CC5)S(=O)(=O)N |
−8.8
± 0.4
|
6.4
± 0.3
|
| 624 |
EN300-14458_1
|
|
CC(C(=O)N(C)C)O[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.2
|
6.4
± 0.1
|
| 625 |
EN300-124918_4
|
|
Cn1c(=O)[nH]c(n1)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
6.4
± 0.3
|
| 626 |
EN300-23129_2
|
|
CC(=O)NCCNC(=O)COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.4
|
6.4
± 0.3
|
| 627 |
EN300-23223_1
|
|
CNC(=O)CNC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 628 |
EN300-6486576_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5nnc(o5)N6CCOCC6 |
−8.8
± 0.3
|
6.4
± 0.2
|
| 629 |
EN300-154201_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCOCC5CO |
−8.8
± 0.2
|
6.4
± 0.2
|
| 630 |
EN300-69162_3
|
|
CC(COC)C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.4
|
6.4
± 0.3
|
| 631 |
EN300-2723070_4
|
|
CN(C)C1COCC1OCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.5
|
6.4
± 0.4
|
| 632 |
DAR-DIA-0d514e7d-1
|
|
C[C@H]1COc2c(cc(cc2OC)Cl)[C@@H]1C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.1
|
6.38
± 0.09
|
| 633 |
EN300-05754_2
|
|
CC(C(=O)N1CCOCC1)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.4
|
6.4
± 0.3
|
| 634 |
EN300-7456499_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCCS(=O)(=O)CCCO |
−8.7
± 0.4
|
6.4
± 0.3
|
| 635 |
BEN-BAS-5c03e89e-1
|
|
CC(C)(C1COc2ccc(cc2C1C(=O)Nc3cncc4c3cccc4)Cl)O |
−8.7
± 0.1
|
6.36
± 0.08
|
| 636 |
EN300-6736851_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N[C@@H]5C[C@H]6[C@@H]5C[C@@H]([C@@H]6O)O |
−8.7
± 0.3
|
6.4
± 0.3
|
| 637 |
EN300-1425608_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C(C5)CO)CCO |
−8.7
± 0.3
|
6.4
± 0.2
|
| 638 |
EN300-46832_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NCC5CCOC5 |
−8.7
± 0.3
|
6.4
± 0.2
|
| 639 |
EN300-103144_2
|
|
CSCCC(C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.7
± 0.2
|
6.4
± 0.2
|
| 640 |
EN300-175186_2
|
|
CC(CO)OC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.2
|
6.3
± 0.1
|
| 641 |
EN300-6501360_2
|
|
CN(C)C(=O)NCC(COC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.7
± 0.4
|
6.3
± 0.3
|
| 642 |
EN300-01527_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NCC5CCCO5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 643 |
EN300-39501_2
|
|
COCCS(=O)(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
6.3
± 0.3
|
| 644 |
EN300-23129_3
|
|
CC(=O)NCCNC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 645 |
EN300-13287_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)Cn5ccc(=O)[nH]c5=O |
−8.7
± 0.3
|
6.3
± 0.2
|
| 646 |
EN300-861925_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC(CO)F |
−8.7
± 0.2
|
6.3
± 0.1
|
| 647 |
EN300-222969_2
|
|
CN1CC(OC1=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 648 |
EN300-861925_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC(CO)F |
−8.7
± 0.4
|
6.3
± 0.3
|
| 649 |
EN300-88131_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC[C@@H](C5)CO |
−8.7
± 0.3
|
6.3
± 0.2
|
| 650 |
EN300-35592_1
|
|
Cn1cc(cc1C(=O)N)C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 651 |
EN300-23318_3
|
|
CC(C(=O)NC1CCS(=O)(=O)C1)OCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.4
|
6.3
± 0.3
|
| 652 |
EN300-219330_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCCN5CCOCC5=O |
−8.7
± 0.3
|
6.3
± 0.2
|
| 653 |
EN300-13890_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CSC5CCS(=O)(=O)C5 |
−8.7
± 0.4
|
6.3
± 0.3
|
| 654 |
EN300-19700_4
|
|
COC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.2
|
6.3
± 0.1
|
| 655 |
EN300-11195_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)N5CCC5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 656 |
EN300-2008120_2
|
|
C[C@H]1[C@H](CCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.2
|
6.3
± 0.1
|
| 657 |
EN300-31562_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5c[nH]nc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 658 |
EN300-263601_2
|
|
COC[C@H]1C[C@H](CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.4
|
6.3
± 0.3
|
| 659 |
EN300-37195_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)NC5CCCCNC5=O |
−8.7
± 0.2
|
6.3
± 0.1
|
| 660 |
EN300-154693_1
|
|
CNC(=O)CCCCC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 661 |
EN300-1724771_3
|
|
CC(=O)N1CCN(CC1)C(=O)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
6.3
± 0.2
|
| 662 |
EN300-25572_4
|
|
CC1CN(CCO1)C(=O)COCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.4
|
6.3
± 0.3
|
| 663 |
EN300-2723070_3
|
|
CN(C)C1COCC1OCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 664 |
EN300-1253178_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)NC5CC5 |
−8.6
± 0.2
|
6.3
± 0.2
|
| 665 |
EN300-342462_2
|
|
CN1CCC(CC1)NC(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.6
± 0.4
|
6.3
± 0.3
|
| 666 |
EN300-7355737_3
|
|
Cn1cc(c(n1)COCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)N |
−8.6
± 0.4
|
6.3
± 0.3
|
| 667 |
EN300-257790_1
|
|
CCC(=O)N1CCN(C1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 668 |
DAR-DIA-23e5a6a0-6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4CC5CCC6(N5)CCC6)Cl |
−8.6
± 0.3
|
6.3
± 0.2
|
| 669 |
EN300-267469_1
|
|
CS(=NC(=O)CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(=O)C |
−8.6
± 0.3
|
6.3
± 0.2
|
| 670 |
EN300-365281_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]6CCCN6C[C@@H]5CO |
−8.6
± 0.3
|
6.3
± 0.2
|
| 671 |
ALP-POS-d3acb8cc-1
|
|
C[C@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.6
± 0.1
|
6.28
± 0.07
|
| 672 |
EN300-31969_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)C5CC(=O)N(C5)CC6CC6 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 673 |
ADA-UCB-dc2b944c-15
|
|
CC1(COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)C |
−8.6
± 0.1
|
6.3
± 0.1
|
| 674 |
EN300-02015_4
|
|
COCCNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.6
± 0.4
|
6.3
± 0.3
|
| 675 |
EN300-14458_3
|
|
CC(C(=O)N(C)C)OCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 676 |
EN300-13499_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCCCNC(=O)N |
−8.6
± 0.3
|
6.3
± 0.2
|
| 677 |
ADA-UCB-dc2b944c-9
|
|
c1ccc2c(c1)cnc(c2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl)Br |
−8.6
± 0.1
|
6.27
± 0.10
|
| 678 |
EN300-310888_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCc5nnc6n5CCOCC6 |
−8.6
± 0.4
|
6.3
± 0.3
|
| 679 |
EN300-05512_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)NC5CCS(=O)(=O)C5 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 680 |
EN300-10729_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCNC(=O)N |
−8.6
± 0.3
|
6.3
± 0.2
|
| 681 |
EN300-172481_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(C5)(C(=O)N)O |
−8.6
± 0.4
|
6.3
± 0.3
|
| 682 |
EN300-18064_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCOCC5 |
−8.6
± 0.3
|
6.3
± 0.2
|
| 683 |
DAR-DIA-0d514e7d-3
|
|
CC1(COc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)C |
−8.6
± 0.1
|
6.2
± 0.1
|
| 684 |
EN300-216032_2
|
|
CC1(COC1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.6
± 0.3
|
6.2
± 0.2
|
| 685 |
EN300-263590_2
|
|
c1cc2c(c(cnc2)NC(=O)[C@]3(c4c(ccc(c4)Cl)OCC3)CCC(=O)N[C@H]5C[C@H](C5)C(=O)N)cc1 |
−8.6
± 0.3
|
6.2
± 0.3
|
| 686 |
EN300-365993_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC6CS(=O)(=O)CC6C5 |
−8.6
± 0.4
|
6.2
± 0.3
|
| 687 |
EN300-65978_2
|
|
Cn1cc(cn1)CN(C)C(=O)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.6
± 0.4
|
6.2
± 0.3
|
| 688 |
EN300-307336_2
|
|
CC1(CC(CN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O)CO |
−8.6
± 0.3
|
6.2
± 0.2
|
| 689 |
EN300-20496_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC5CCOC5=O |
−8.6
± 0.2
|
6.2
± 0.2
|
| 690 |
EN300-04492_3
|
|
COCCCNC(=O)COCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.6
± 0.3
|
6.2
± 0.2
|
| 691 |
EN300-62449_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCNC(=O)C5CCC5 |
−8.5
± 0.3
|
6.2
± 0.2
|
| 692 |
EN300-10895_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOCC(=O)NCCC#N |
−8.5
± 0.5
|
6.2
± 0.3
|
| 693 |
BEN-DND-c852c98b-1
|
|
c1cc2cncc(c2cc1C#N)NC(=O)C3CCOc4c3cc(cc4)Cl |
−8.54
± 0.06
|
6.22
± 0.04
|
| 694 |
EN300-223964_3
|
|
CC[C@@H](C(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)N(C)C |
−8.5
± 0.5
|
6.2
± 0.3
|
| 695 |
BEN-DND-c852c98b-4
|
|
c1cc2cncc(c2cc1O)NC(=O)C3CCOc4c3cc(cc4)Cl |
−8.53
± 0.06
|
6.22
± 0.04
|
| 696 |
EN300-333677_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@@H]([C@@H](C5)CO)CO |
−8.5
± 0.3
|
6.2
± 0.2
|
| 697 |
EN300-717233_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CC6CNCCN6S5(=O)=O |
−8.5
± 0.5
|
6.2
± 0.3
|
| 698 |
EN300-6759637_2
|
|
C[C@@H]1CN(C[C@H](O1)CO)C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.5
± 0.3
|
6.2
± 0.2
|
| 699 |
EN300-65978_1
|
|
Cn1cc(cn1)CN(C)C(=O)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.5
± 0.3
|
6.2
± 0.2
|
| 700 |
EDJ-MED-e4b030d8-2
|
|
C[C@@H]1C[C@H](c2cc(ccc2O1)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.52
± 0.05
|
6.20
± 0.04
|