| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 4601 |
EN300-7432415_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5C6(CCC6)OC(=O)N5 |
−8.8
± 0.2
|
| 4602 |
BEN-BAS-c2bc0d80-5_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3[nH]c(cc4=O)Cl |
−8.8
± 0.3
|
| 4603 |
EN300-379533_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)O |
−8.8
± 0.3
|
| 4604 |
EN300-379533_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC(CC5)O |
−8.8
± 0.3
|
| 4605 |
JOH-UNI-3fc3434e-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](CC#N)c3cccc(c3)Cl |
−8.8
± 0.3
|
| 4606 |
DAR-DIA-23e5a6a0-5_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@H]5CC6([NH2+]5)CC6)Cl |
−8.8
± 0.3
|
| 4607 |
EN300-216594_2_1_1 |
|
Cn1cncc1CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4608 |
EN300-216594_2_1_1 |
|
Cn1cncc1CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4609 |
EN300-171215_1_2_1 |
|
C[C@H]1CS(=O)(=O)CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4610 |
EN300-171215_1_2_1 |
|
C[C@H]1CS(=O)(=O)CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4611 |
FRA-DIA-b66f7109-2_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3COc4c3cc(cc4Cl)O[C@H]5CC(=O)N5 |
−8.8
± 0.3
|
| 4612 |
MAK-UNK-8be7dca9-1_1_1
|
|
c1cc2c(cc1CN3CC[NH2+]CC3)cncc2NC(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−8.8
± 0.1
|
| 4613 |
RAL-THA-8416115c-13_3
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)Cc5[nH]ncn5 |
−8.8
± 0.3
|
| 4614 |
EN300-7464289_1_1_1 |
|
C[C@@](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C(=O)OC)F |
−8.8
± 0.3
|
| 4615 |
EN300-6729572_4_1_1 |
|
C[C@@H]([C@@H]1C[C@@H]1C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.4
|
| 4616 |
RAL-THA-4aa06b95-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCN(c4c3cc(cc4)Cl)C(=O)CO |
−8.8
± 0.3
|
| 4617 |
EN300-148865_2_1_1 |
|
C[C@@H](CCO)NC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4618 |
EN300-86282_2_1_1 |
|
C[C@@H](CO)NC(=O)CC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4619 |
EN300-297611_1_2_1 |
|
C[C@H]1CN(CC[N@@]1S(=O)(=O)C)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.4
|
| 4620 |
EN300-39785_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)NCc5ccn[nH]5 |
−8.8
± 0.3
|
| 4621 |
EDJ-MED-28ec730d-3_1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC5CCOCC5 |
−8.8
± 0.2
|
| 4622 |
EN300-311920_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@]5(CCS(=O)(=O)C5)F |
−8.8
± 0.2
|
| 4623 |
EN300-754584_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CS(=O)(=O)CC(=O)N5 |
−8.8
± 0.3
|
| 4624 |
EN300-383664_1_1_1 |
|
Cn1cc(ncc1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
| 4625 |
EN300-20284_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCC(=O)N5CCC[C@H](C5)O |
−8.8
± 0.2
|
| 4626 |
EN300-155498_3_1_1 |
|
CC(=C)[C@H](CC(=O)NCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.3
|
| 4627 |
EN300-190353_1_1_1 |
|
Cc1cccc(=O)n1C[C@@](C)(C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.8
± 0.3
|
| 4628 |
EN300-1272704_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N[C@@H]5CCO[C@@H]5c6[nH]ncn6 |
−8.8
± 0.3
|
| 4629 |
EN300-91905_2_1_1 |
|
C[C@@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.2
|
| 4630 |
DAR-DIA-23e5a6a0-6_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4C[C@H]5CCC6([NH2+]5)CCC6)Cl |
−8.8
± 0.3
|
| 4631 |
ALP-POS-966f8da6-2_2
|
|
CC(=O)N1CC[C@H](c2c1ccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4632 |
MAT-POS-de59a476-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3ccc(c(c3)Cl)Cl)O |
−8.8
± 0.3
|
| 4633 |
EDG-MED-ba1ac7b9-16_2
|
|
Cn1cncc1CN(C2CC2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.4
|
| 4634 |
EDG-MED-90036822-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(CNCC(=O)N)(F)F |
−8.8
± 0.3
|
| 4635 |
EN300-1448674_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CCn6c(ncn6)C5 |
−8.8
± 0.3
|
| 4636 |
EN300-68794_3_1_1 |
|
CS(=O)(=O)CCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4637 |
EN300-68794_3_1_1 |
|
CS(=O)(=O)CCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4638 |
EN300-68794_3_1_1 |
|
CS(=O)(=O)CCCOCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.8
± 0.3
|
| 4639 |
EN300-7436306_4_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@@H]5[C@H]6COC[C@H]6ON5 |
−8.8
± 0.4
|
| 4640 |
EN300-98038_1_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC[C@@H]5[NH2+]NC(=O)N5 |
−8.8
± 0.3
|
| 4641 |
MAK-UNK-c749d764-8_7
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−8.8
± 0.3
|
| 4642 |
EN300-225560_1_1_1 |
|
CCn1c(cnn1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
| 4643 |
EN300-251851_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)CCc5n[n-]nn5 |
−8.8
± 0.2
|
| 4644 |
EN300-77464_2_1_1 |
|
C[C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.2
|
| 4645 |
EN300-47606_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCOCC(=O)NC[C@@H]5CCS(=O)(=O)C5 |
−8.8
± 0.4
|
| 4646 |
EN300-33478_1_2_1 |
|
CCN1C[C@H](CC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4647 |
EN300-43090_2_1_1 |
|
Cc1nnc(o1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.2
|
| 4648 |
EN300-7438575_2_1_2 |
|
C[C@@H]([C@H]1[C@H]2COC[C@H]2ON1)NC(=O)CC[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.3
|
| 4649 |
EN300-99983_2_1_1 |
|
CNC(=O)Cc1nc(on1)COC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.8
± 0.3
|
| 4650 |
EDG-MED-90036822-81_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H](CC5C[NH2+]C5)F |
−8.8
± 0.3
|
| 4651 |
EDJ-MED-ee07cf00-11_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)NC(=O)[C@@H]4CC[C@@H](O4)C(=O)N5CCCC5 |
−8.8
± 0.6
|
| 4652 |
EN300-269453_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5CCc6nnnn6C5 |
−8.8
± 0.3
|
| 4653 |
EN300-178515_3_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCNC(=O)CCC(=O)N |
−8.8
± 0.3
|
| 4654 |
EN300-16216_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NCC(=O)N |
−8.8
± 0.2
|
| 4655 |
EN300-7465104_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)NC5CC(C5)(C6(CCC6)O)O |
−8.8
± 0.3
|
| 4656 |
VLA-UCB-34f3ed0c-13_1
|
|
c1ccc2c(c1)cncc2NC(=O)N(CCN3CC[NH2+]CC3)c4cccc(c4)Cl |
−8.8
± 0.4
|
| 4657 |
EN300-46832_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)COCC(=O)NC[C@H]5CCOC5 |
−8.8
± 0.3
|
| 4658 |
EN300-1605566_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H]5CN6CC[NH+]5CC6 |
−8.8
± 0.4
|
| 4659 |
FRA-DIA-b66f7109-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CNc4c3cc(cc4Cl)O[C@@H]5CC(=O)N5 |
−8.8
± 0.3
|
| 4660 |
EN300-722418_1_3_1 |
|
C[C@@H](CN(C[C@H](C)O)C(=O)C[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−8.8
± 0.4
|
| 4661 |
EN300-246248_4_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CCCOC[C@H]5CCNC5=O |
−8.8
± 0.4
|
| 4662 |
DAR-DIA-9e4459de-11_4
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−8.8
± 0.4
|
| 4663 |
EDJ-MED-ee07cf00-11_8
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)NC(=O)[C@H]4CC[C@H](O4)C(=O)N5CCCC5 |
−8.8
± 0.5
|
| 4664 |
EN300-159953_1_1_1 |
|
CN([C@@H]1CC[N@@H+]2CCO[C@H]1C2)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−8.8
± 0.4
|
| 4665 |
EN300-7461217_2_2_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5C[C@H]([C@@H](C5)F)O |
−8.8
± 0.3
|
| 4666 |
MAT-POS-f9802937-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCNc4c3cc(c(c4)Cl)Cl |
−8.8
± 0.2
|
| 4667 |
GIA-UNK-80c9bc96-1_1
|
|
c1ccc2c(c1)cncc2N3CC[C@@H](C3=O)c4cccc(c4)Cl |
−8.8
± 0.3
|
| 4668 |
ADA-UCB-dc2b944c-11_1
|
|
c1ccc2c(c1)c(cnc2Br)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−8.75
± 0.09
|
| 4669 |
DAR-DIA-0d514e7d-32_23
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3[C@H]4C[C@H]4CO[C@@H]5[C@H]3C=C(C=C5)Cl |
−8.8
± 0.2
|
| 4670 |
MAT-POS-fce787c2-5_1
|
|
C[NH2+][C@@H](c1ccc(c(c1)Cl)Cl)C(=O)Nc2cncc3c2cccc3 |
−8.8
± 0.4
|
| 4671 |
MIC-UNK-50cce87d-6_2
|
|
c1cc(cc(c1)Cl)[C@H]2CCN(C2=O)c3cncc4c3c(ccc4)Cl |
−8.8
± 0.3
|
| 4672 |
MIC-UNK-644c43c7-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)CNC(C(F)(F)F)C(F)(F)F |
−8.8
± 0.4
|
| 4673 |
EN300-181938_4_2_1 |
|
C[C@](CC(=O)NCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(C=C)O |
−8.8
± 0.3
|
| 4674 |
EN300-78727_1_1_1 |
|
Cc1nc(no1)CNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
| 4675 |
DAR-DIA-9e4459de-15_10
|
|
c1cc2c(c(c1)NC(=O)CCC(=O)Nc3ccc4c(c3)cncc4NC(=O)[C@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−8.7
± 0.6
|
| 4676 |
EN300-188585_1_1_1 |
|
CC1(CCS(=O)(=O)CC1)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
| 4677 |
EN300-39101_1_1_1 |
|
CCOC(=O)N(C)CC(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
| 4678 |
EN300-7457160_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OC[C@@H]5C[C@H](ON5)CC6(COC6)O |
−8.7
± 0.4
|
| 4679 |
EN300-02015_4_1_1 |
|
COCCNC(=O)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
| 4680 |
EDG-MED-90036822-30_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C(CNC5COC5)(F)F |
−8.7
± 0.3
|
| 4681 |
EN300-299532_2_2_1 |
|
CC(C)([C@H](C(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O)O |
−8.7
± 0.2
|
| 4682 |
EDG-MED-90036822-97_1
|
|
C[NH+]1CCC(CC1)[C@H](CC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.3
|
| 4683 |
DAR-DIA-0d514e7d-20_1_1
|
|
C[C@H]1COc2c(cc(cc2N3CCOCC3)Cl)[C@@H]1C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.2
|
| 4684 |
MAK-UNK-c749d764-26_3
|
|
c1ccc2c(c1)cncc2NC(=O)C[C@@H]3CCCC[C@H]([C@@H]3O)Cl |
−8.7
± 0.3
|
| 4685 |
EN300-7399047_1_1_1 |
|
CC(=O)N[C@@H](CCC(=O)N)C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
| 4686 |
DAR-DIA-0d514e7d-27_1
|
|
C[C@@]1(c2cc(cc(c2OCC1(C)C)OC)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.2
|
| 4687 |
EN300-244947_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCc5cn[nH]n5 |
−8.7
± 0.3
|
| 4688 |
EN300-179091_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)COC(F)F |
−8.7
± 0.2
|
| 4689 |
EN300-23317_2_2_1 |
|
C[C@H](C(=O)NCCOC)OC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
| 4690 |
EDJ-MED-ee07cf00-18_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)CN4CCN(C4=O)C5CC5 |
−8.7
± 0.5
|
| 4691 |
EN300-36851_1_2_1 |
|
C[C@H]1C[C@@H]1C(=O)NCCC(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
| 4692 |
ED_-GRI-5b13fbe2-10_2
|
|
C[C@](CO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)(c5n[n-]nn5)[NH3+] |
−8.7
± 0.3
|
| 4693 |
EN300-180575_2_1_1 |
|
C[C@@H]1CCS(=O)(=O)CCN1C(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−8.7
± 0.3
|
| 4694 |
EN300-36731_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5c(ccs5)n6cnnn6 |
−8.7
± 0.2
|
| 4695 |
EN300-218116_4_1_1 |
|
CC(CO)(CO)COCCC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.4
|
| 4696 |
EN300-73582_2_1_1 |
|
CCS(=O)(=O)NCCOC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−8.7
± 0.3
|
| 4697 |
EN300-244659_1_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5C[C@H](C[C@H]5CO)F |
−8.7
± 0.3
|
| 4698 |
EDG-MED-ba1ac7b9-27_8
|
|
C[C@H]1C[N@H+](CCN1C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CCO |
−8.7
± 0.6
|
| 4699 |
EN300-1709202_2_1_1 |
|
COC[C@@H](C1(CC1)NC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O |
−8.7
± 0.4
|
| 4700 |
EN300-360158_3_1_1 |
|
CC1(C[C@@](CO1)(CC(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)O)C |
−8.7
± 0.4
|