| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 2501 |
EDG-MED-90036822-73_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5[C@@H]6[N@H+]5CCC6 |
−6.4
± 0.4
|
| 2502 |
EDJ-MED-93390d0c-3_1
|
|
CO[C@@]1(CCOc2c1cc(c(c2)F)Cl)C(=O)Nc3cncc4c3ccc(c4)S(=O)(=O)C |
−6.4
± 0.3
|
| 2503 |
MAT-POS-e9e99895-2_4
|
|
CC(C)[N@H+]1CCO[C@H](C1)C(=O)N[C@@](C)(c2ccc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.41
± 0.09
|
| 2504 |
EDJ-MED-b7309adf-2_2
|
|
c1cc2c(cc1Cl)cncc2NC(=O)[C@H]3CCS(=O)(=O)c4c3cc(cc4)Cl |
−6.4
± 0.2
|
| 2505 |
DAR-DIA-23e5a6a0-5_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@@H]5CC6([NH2+]5)CC6)Cl |
−6.4
± 0.4
|
| 2506 |
DAR-DIA-0d514e7d-32_12
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3[C@H]4C[C@@H]4CO[C@H]5[C@@H]3C=C(C=C5)Cl |
−6.4
± 0.2
|
| 2507 |
DAR-DIA-0cde14eb-56_1
|
|
C[C@@H](c1cccc(c1)C2(CC2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.1
|
| 2508 |
EDG-MED-4c68219f-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCC(=O)N5CC(C5)[NH2+]C6COC6 |
−6.4
± 0.4
|
| 2509 |
MAK-UNK-c749d764-10_7
|
|
CSN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−6.4
± 0.6
|
| 2510 |
MAK-UNK-8be7dca9-5_2
|
|
c1cc2c(cc1C[NH3+])cncc2NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−6.4
± 0.4
|
| 2511 |
MAT-POS-fb82b63d-2_2
|
|
C[C@]1(c2cc(ccc2CC[NH2+]1)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.2
|
| 2512 |
EDJ-MED-670ad2ee-7_1
|
|
CN(C)S(=O)(=O)[N@@]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cc(cc4)F)Cl |
−6.4
± 0.5
|
| 2513 |
ERI-UCB-b3e6b0c2-3_2
|
|
C[N@]1C[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cc(cc4)C[NH3+] |
−6.4
± 0.4
|
| 2514 |
DAR-DIA-ecdbc7dd-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCNc4c3cc(cc4)Cl)C[NH+]5CCOCC5 |
−6.4
± 0.2
|
| 2515 |
DAR-DIA-ecdbc7dd-7_1
|
|
CN1CC[NH+](CC1)C[C@@]2(CCNc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−6.40
± 0.08
|
| 2516 |
VLA-UNK-c65c1026-6_1
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@]4(CNC3=O)COc5c4cc(cc5)Cl |
−6.4
± 0.2
|
| 2517 |
ALF-EVA-07677224-10_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)c5[nH]ncn5 |
−6.4
± 0.2
|
| 2518 |
MAT-POS-dd3ad2b5-1_2
|
|
C[N@H+]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−6.4
± 0.2
|
| 2519 |
EDJ-MED-139368ae-3_3
|
|
COC1CN(C1)S(=O)(=O)[N@@]2Cc3ccccc3[C@H](C2)C(=O)Nc4cncc5c4cccc5 |
−6.4
± 0.2
|
| 2520 |
RAL-THA-05e671eb-8_1
|
|
COc1ccc2c(c1)[C@@H](CCO2)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.4
|
| 2521 |
EDJ-MED-841e0cf0-7_2
|
|
CNS(=O)(=O)[N@]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cc(cc4)F)Cl |
−6.4
± 0.3
|
| 2522 |
PET-UNK-dd44aeb6-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3C#N)Cl |
−6.4
± 0.3
|
| 2523 |
NAU-LAT-2fed8305-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)C[N@@H+]3CCC=C(C3)F |
−6.4
± 0.5
|
| 2524 |
MAT-POS-4223bc15-9_7
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)[C@H]5CCC[C@@H]5O |
−6.4
± 0.2
|
| 2525 |
DAR-DIA-0f2f46c9-10_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CC[N@](c4c3cc(cc4)Cl)S(=O)(=O)[O-] |
−6.4
± 0.3
|
| 2526 |
ALP-POS-347519b5-2_24
|
|
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 |
−6.4
± 0.2
|
| 2527 |
DAR-DIA-0587064e-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)OCc4ccccc4Cl |
−6.4
± 0.2
|
| 2528 |
ALP-UNI-8e43a71e-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CC(=O)Nc5ccn(n5)[C@@H]6CCNC6=O |
−6.38
± 0.07
|
| 2529 |
MAT-POS-e9e99895-8_4
|
|
Cc1nc2n(n1)C[C@H](CC2)C(=O)N[C@](C)(c3ccc(c(c3)Cl)Cl)C(=O)Nc4cncc5c4cccc5 |
−6.38
± 0.09
|
| 2530 |
MAT-POS-4223bc15-16_13
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)[N@]5CCC[C@H]5CO |
−6.4
± 0.2
|
| 2531 |
ALF-EVA-b701bd13-2_2
|
|
CC(=O)Nc1ccc2c(c1)cncc2NC(=O)[C@H]3CCNc4c3cc(c(c4)Cl)Cl |
−6.4
± 0.2
|
| 2532 |
MAT-POS-dc2604c4-4_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)CCC#N |
−6.4
± 0.2
|
| 2533 |
DAR-DIA-9e4459de-11_10
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−6.4
± 0.4
|
| 2534 |
ERI-UCB-b3e6b0c2-14_1
|
|
c1cc2c(cc1CN3CC[NH2+]CC3)cncc2NC(=O)[C@@H]4COc5c4cc(cc5)Cl |
−6.4
± 0.2
|
| 2535 |
EDG-MED-90036822-74_1
|
|
C[N@@H+]1C[C@@H](C[C@@H]1C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)F |
−6.4
± 0.4
|
| 2536 |
MAK-UNK-c749d764-28_1
|
|
c1ccc2c(c1)cncc2N(C=O)C(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−6.4
± 0.4
|
| 2537 |
DAR-DIA-0587064e-12_2
|
|
CCCOc1cc(cc2c1OCC[C@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−6.38
± 0.10
|
| 2538 |
EDJ-MED-f893e2a1-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)C[NH2+]CC5(CCC5)CO |
−6.4
± 0.1
|
| 2539 |
MAT-POS-24589f88-16_1
|
|
Cn1ccc(n1)C[N@@H+]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cc(cc5)F)Cl |
−6.38
± 0.10
|
| 2540 |
BEN-DND-d1eb1f41-8_1
|
|
c1ccc2c(c1)cncc2N3CC[N@@H+]4Cc5ccc(cc5[C@@H]4C3=O)Cl |
−6.4
± 0.4
|
| 2541 |
ED_-GRI-5b13fbe2-50_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@H]5C[C@]5(C#N)C(=O)[O-] |
−6.4
± 0.5
|
| 2542 |
VLA-UNK-f49ebb87-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3c4cc(ccc4NC(=O)O3)Cl |
−6.4
± 0.2
|
| 2543 |
KAD-UNI-8a629cb0-18_1
|
|
Cc1ccn2c(n1)nc(n2)C(=O)NCC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−6.4
± 0.4
|
| 2544 |
PET-UNK-88d26eaf-1_2
|
|
CN(C)S(=O)(=O)[N@]1Cc2ccc(cc2[C@@](C1)(C(=O)Nc3cncc4c3cccc4)OC)Cl |
−6.4
± 0.3
|
| 2545 |
RAL-THA-8416115c-3_1
|
|
CCN1CC[C@@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.2
|
| 2546 |
MAK-UNK-c749d764-26_7
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCCC[C@H]([C@H]3O)Cl |
−6.4
± 0.2
|
| 2547 |
MIC-UNK-45817b9b-2_1
|
|
CN1c2ccc(cc2[C@@H](CC1=O)C(=O)Nc3cncc4c3cccc4)Cl |
−6.4
± 0.3
|
| 2548 |
EDJ-MED-37aac4bd-1_1
|
|
CO[C@@]1(CCOc2c1cc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.37
± 0.09
|
| 2549 |
MAK-UNK-ffc90da7-9_3
|
|
C[C@@H]1[C@H](CCO1)SC[C@@H](C)c2ccc3c(c2)cncc3NC(=O)Cc4cccc(c4)Cl |
−6.4
± 0.3
|
| 2550 |
ALP-UNI-dbbfd3db-6_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CC[C@H](O5)C(=O)N6CCCC6 |
−6.4
± 0.3
|
| 2551 |
KAD-UNI-877d7bed-4_1
|
|
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCOc3cc(cc4c3OCC[C@@H]4C(=O)Nc5cncc6c5cccc6)Cl |
−6.4
± 0.3
|
| 2552 |
PET-UNK-6314f867-2_1
|
|
c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2ccc(c3)C#N |
−6.4
± 0.2
|
| 2553 |
RYA-UNI-6d7114fd-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(c(c4)Cl)Cl |
−6.4
± 0.3
|
| 2554 |
DAR-DIA-0587064e-13_1
|
|
CCCOc1cc(cc2c1NCC[C@@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−6.4
± 0.3
|
| 2555 |
MIC-UNK-ea4eb352-10_2
|
|
CO[C@]1(C[N@@](Cc2c1cc(c(c2)F)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.3
|
| 2556 |
MAT-POS-dd3ad2b5-1_3
|
|
C[N@@H+]1Cc2ccc(cc2[C@H](C1)C(=O)Nc3cncc4c3cccc4)Cl |
−6.4
± 0.2
|
| 2557 |
ALP-UNI-8e43a71e-3_1
|
|
CC(=O)N1C[C@H]2C[C@@H]1CN2C(=O)C[C@@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−6.36
± 0.09
|
| 2558 |
RAL-THA-8416115c-9_4
|
|
CN(C)C(=O)CN1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.36
± 0.10
|
| 2559 |
DAR-DIA-0d514e7d-19_1
|
|
C[C@H]1COc2c(cc(cc2OC(C)(C)C)Cl)[C@@H]1C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.4
|
| 2560 |
EDJ-MED-611d11e7-3_1
|
|
CS(=O)(=O)c1ccc2cncc(c2c1)NC(=O)[C@@H]3CCOc4c3cc(c(c4)F)Cl |
−6.36
± 0.08
|
| 2561 |
MAK-UNK-c749d764-21_6
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F |
−6.4
± 0.5
|
| 2562 |
PET-UNK-1320d94d-27_1
|
|
CN([C@H](c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3)C(=O)[C@@H]4C[C@@H](O4)C(=O)N5CCCC5 |
−6.4
± 0.2
|
| 2563 |
EDJ-MED-2f867453-2_1
|
|
C[C@@]1(CNc2c1cc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.3
|
| 2564 |
BEN-DND-c852c98b-5_2
|
|
CS(=O)(=O)c1ccc2cncc(c2c1)NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−6.35
± 0.10
|
| 2565 |
RAL-THA-e002e396-1_2
|
|
CS(=O)(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.4
± 0.2
|
| 2566 |
FRA-DIA-6238d354-1_2
|
|
CO[C@]1(C[N@](Cc2c1cc(cc2)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cc(cc4)S(=O)(=O)C |
−6.4
± 0.2
|
| 2567 |
VLA-MRT-8c78ee15-4_2
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@]4(C[N@H+](Cc5c4cc(cc5)Cl)CC(=O)N)NC3=O |
−6.4
± 0.4
|
| 2568 |
MIC-UNK-d854bf4c-5_1
|
|
CS(=O)(=O)N1CCC2(CC1)CN(C(=O)[C@@H]2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−6.4
± 0.1
|
| 2569 |
RAL-THA-b00e3cbf-1_2
|
|
c1ccc2c(c1)c(cnc2C#N)NC(=O)[C@H]3CCOc4c3cc(cc4)Cl |
−6.4
± 0.2
|
| 2570 |
ALP-POS-a0a4abd7-9_2
|
|
Cc1cc(c[nH]c1=O)CCN(c2cncc3c2cccc3)C(=O)[C@H]4CCOc5c4ccc(c5)Cl |
−6.4
± 0.1
|
| 2571 |
EDJ-MED-ee07cf00-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)Cn4cc(c(=O)[nH]c4=O)Cl |
−6.35
± 0.09
|
| 2572 |
DAR-DIA-4987d2cd-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3c4cc(ccc4CN3c5c(c(=O)c5=O)[O-])Cl |
−6.4
± 0.2
|
| 2573 |
PET-UNK-b566c0b0-7_2
|
|
CN(C)S(=O)(=O)[N@]1Cc2ccccc2[C@@](C1)(C(=O)Nc3cncc4c3cc(cc4)S(=O)(=O)C)OC |
−6.3
± 0.3
|
| 2574 |
RAL-THA-2d450e86-19_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cccc(c3F)Cl |
−6.35
± 0.10
|
| 2575 |
ALP-POS-347519b5-1_48
|
|
CS(=O)(=O)[N@]1C[C@H]2[C@H]3CC[C@H](C3)[C@@H]2[C@H](C1)C(=O)Nc4cncc5c4cccc5 |
−6.3
± 0.3
|
| 2576 |
BEN-DND-f2e727cd-3_1
|
|
C[N@@]1CCN(c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.3
± 0.6
|
| 2577 |
EDJ-MED-923a35c2-3_2
|
|
C[C@]1(C[N@@](Cc2c1cc(c(c2)F)Cl)S(=O)(=O)C)C(=O)Nc3cncc4c3cc(cc4)S(=O)(=O)C |
−6.3
± 0.1
|
| 2578 |
ALP-UNI-76695c4f-4_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]6CS(=O)(=O)C[C@H]6C5 |
−6.3
± 0.3
|
| 2579 |
EDJ-MED-40433386-9_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCc6ncnn6C5 |
−6.3
± 0.3
|
| 2580 |
LAU-MED-88a3970a-9_1
|
|
CS(=O)(=O)CCc1cc(cc2c1OCC[C@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−6.3
± 0.4
|
| 2581 |
VLA-UCB-05e51b3f-15_1
|
|
c1ccc2c(c1)cncc2N(C(=O)Cc3cccc(c3)Cl)C(=O)CCl |
−6.3
± 0.4
|
| 2582 |
ERI-UCB-ce40166b-2_2
|
|
c1ccc2c(c1)cncc2CC(=O)Nc3cccc(c3)O[C@H]4CCC(=O)N4 |
−6.3
± 0.1
|
| 2583 |
MAK-UNK-c749d764-25_2
|
|
COC(=O)N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−6.3
± 0.3
|
| 2584 |
EDJ-MED-ee07cf00-9_1
|
|
c1ccc(cc1)c2nnn(n2)CC(=O)N[C@@H](c3cccc(c3)Cl)C(=O)Nc4cncc5c4cccc5 |
−6.34
± 0.09
|
| 2585 |
EDJ-MED-15e90dfc-3_2
|
|
COCC[NH2+]C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−6.3
± 0.2
|
| 2586 |
MAK-UNK-c749d764-26_6
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@H]3CCCC[C@@H]([C@H]3O)Cl |
−6.3
± 0.3
|
| 2587 |
EDG-MED-ba1ac7b9-33_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[NH+](CC5)[C@H]6CCOC6 |
−6.3
± 0.2
|
| 2588 |
MAT-POS-f9802937-1_2
|
|
CN1c2ccc(cc2[C@](CC1=O)(C(=O)Nc3cncc4c3cccc4)OC)Cl |
−6.3
± 0.3
|
| 2589 |
RAL-THA-2d450e86-28_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3C#N)Cl |
−6.3
± 0.6
|
| 2590 |
BEN-BAS-5c03e89e-2_2
|
|
CC(C)([C@H]1C=Nc2ccc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)O |
−6.3
± 0.3
|
| 2591 |
RAL-THA-2d450e86-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(cc3)Cl |
−6.33
± 0.10
|
| 2592 |
ALP-UNI-8e43a71e-2_5
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC[C@@H]6[C@H]5CCC[N@@H+]6CCO |
−6.33
± 0.09
|
| 2593 |
RAL-THA-8416115c-11_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)Cc5cnc[nH]5 |
−6.3
± 0.3
|
| 2594 |
KAD-UNI-b13decd3-12_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)C[NH2+]Cc5ccccc5OCC(=O)N |
−6.3
± 0.1
|
| 2595 |
LON-WEI-5e7d1b3e-50_1
|
|
CCCC[N@@H+](CCNC(=O)Nc1cn(c(=O)c2c1cccc2)C)Cc3ccco3 |
−6.3
± 0.4
|
| 2596 |
RAL-THA-05e671eb-15_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3ccc(c4)C#N |
−6.3
± 0.5
|
| 2597 |
MAT-POS-4223bc15-11_3
|
|
C[C@@H]1CC[N@](C1)S(=O)(=O)[N@@]2Cc3ccc(cc3[C@@H](C2)C(=O)Nc4cncc5c4cccc5)Cl |
−6.33
± 0.10
|
| 2598 |
RAL-THA-eb6cb89c-1_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]34CC[C@H](O3)c5c4cccc5 |
−6.3
± 0.3
|
| 2599 |
DAR-DIA-0587064e-22_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4OCc5ccccc5Cl)Cl |
−6.3
± 0.2
|
| 2600 |
MAK-UNK-c749d764-15_11
|
|
C[C@@H](N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F)OCC4CCCCC4 |
−6.3
± 0.6
|