| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 7601 |
MAK-UNK-c749d764-24_8
|
|
CCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@H]([C@H]3O)C(F)F |
−2.4
± 0.5
|
| 7602 |
EN300-14752_4_1_1 |
|
CC(=O)N1CCC[C@@H](C1)C(=O)NCCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−2.4
± 0.3
|
| 7603 |
DAR-DIA-0d514e7d-31_16
|
|
C[C@H]1CCO[C@H]2C=CC(=C[C@H]2[C@H]1C(=O)Nc3cncc4c3cccc4)Cl |
−2.3
± 0.2
|
| 7604 |
EDG-MED-ba1ac7b9-27_2
|
|
C[C@H]1C[N@@H+](CCN1C(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)CCO |
−2.3
± 0.8
|
| 7605 |
MAK-UNK-c749d764-3_8
|
|
CC1(C[NH2+]C1)OCN(c2cncc3c2cccc3)C(=O)C[C@H]4CCC[C@H]([C@H]4O)C(F)F |
−2.3
± 0.6
|
| 7606 |
LON-WEI-4d77710c-35_1
|
|
Cc1ccc(cc1)C[N@@H+]2CC[C@@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−2.3
± 0.8
|
| 7607 |
LON-WEI-5e7d1b3e-60_1
|
|
CC1CC[NH+](CC1)CCCNC(=O)Nc2cn(c(=O)c3c2cccc3)CC(C)C |
−2.2
± 0.6
|
| 7608 |
LON-WEI-4d77710c-34_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)N3CC[C@@H](C3)c4ccccc4 |
−2.2
± 0.6
|
| 7609 |
LON-WEI-4d77710c-13_2
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)NC[C@H]3CCCO3 |
−2.2
± 0.7
|
| 7610 |
MAT-POS-b5746674-108_1
|
|
Cc1ccc(cc1)C[N@@H+]2CC[C@@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−2.2
± 0.6
|
| 7611 |
MAK-UNK-c749d764-19_7
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−2.2
± 0.5
|
| 7612 |
MAK-UNK-c749d764-20_3
|
|
CCCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@@H]3O)C(F)F |
−2.1
± 0.5
|
| 7613 |
EN300-95698_3_2_1 |
|
C[C@H]1CC(=O)NC[C@@H]1C(=O)NCC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−2.1
± 0.3
|
| 7614 |
MAK-UNK-c749d764-20_6
|
|
CCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F |
−2.1
± 0.4
|
| 7615 |
EN300-4287199_2_1_1 |
|
Cc1cc(cc(=O)n1C)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−2.1
± 0.2
|
| 7616 |
MAT-POS-2492181e-7_1
|
|
CC1CC[NH+](CC1)CCNC(=O)Nc2cn(c(=O)c3c2cccc3)CC(C)C |
−2.0
± 0.5
|
| 7617 |
MAK-UNK-c749d764-21_4
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@H]([C@@H]3O)C(F)F |
−2.0
± 0.7
|
| 7618 |
EN300-51028_2_1_1 |
|
CC(C)S(=O)(=O)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−2.0
± 0.2
|
| 7619 |
ALP-POS-5bb456a5-1_6
|
|
C[C@H]1C[N@@](CC[C@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−2.0
± 0.6
|
| 7620 |
MAK-UNK-c749d764-24_6
|
|
CCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F |
−2.0
± 0.4
|
| 7621 |
MAK-UNK-c749d764-24_1
|
|
CCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−2.0
± 0.4
|
| 7622 |
MAK-UNK-c749d764-19_4
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@H]3CCC[C@H]([C@@H]3O)C(F)F |
−2.0
± 0.5
|
| 7623 |
MAT-POS-2492181e-10_4
|
|
C[C@H]1CCCC[N@H+]1CCCNC(=O)Nc2cn(c(=O)c3c2cccc3)CC(C)C |
−2.0
± 0.7
|
| 7624 |
EDJ-MED-d203f206-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCC[C@H]5c6n[n-]nn6 |
−2.0
± 0.4
|
| 7625 |
MAT-POS-2492181e-12_1
|
|
CCC[NH+](CCC)CCNC(=O)Nc1cn(c(=O)c2c1cccc2)CC(C)C |
−1.9
± 0.7
|
| 7626 |
MAK-UNK-c749d764-19_3
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@@H]3CCC[C@H]([C@@H]3O)C(F)F |
−1.9
± 0.4
|
| 7627 |
EN300-259187_1_2_1 |
|
CCN1C[C@H](CCC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−1.9
± 0.3
|
| 7628 |
MAK-UNK-c749d764-19_1
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−1.9
± 0.4
|
| 7629 |
MIC-UNK-5a93dd5f-11_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)[NH+]4CCC(CC4)[NH+]5CCCCC5 |
−1.8
± 0.5
|
| 7630 |
MAK-UNK-c749d764-18_7
|
|
CC(C)SCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−1.8
± 0.8
|
| 7631 |
MAK-UNK-c749d764-24_7
|
|
CCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−1.8
± 0.4
|
| 7632 |
LON-WEI-4d77710c-15_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)NCCCN3CCCC3=O |
−1.8
± 0.8
|
| 7633 |
EDJ-MED-4c7486ba-5_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cn5ccnc5 |
−1.7
± 0.2
|
| 7634 |
EDJ-MED-4c7486ba-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@@]5CC(F)(F)F |
−1.7
± 0.2
|
| 7635 |
MAK-UNK-c749d764-16_4
|
|
C[C@H](N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F)O |
−1.7
± 0.4
|
| 7636 |
ALP-POS-5bb456a5-1_8
|
|
C[C@H]1C[N@](CC[C@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−1.7
± 0.5
|
| 7637 |
MAT-POS-2492181e-6_1
|
|
CC1CC[NH+](CC1)CCCNC(=O)Nc2cn(c(=O)c3c2cccc3)CC(C)C |
−1.7
± 0.6
|
| 7638 |
MAK-UNK-c749d764-21_6
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@H]3O)C(F)F |
−1.6
± 0.4
|
| 7639 |
LON-WEI-4d77710c-35_3
|
|
Cc1ccc(cc1)C[N@@H+]2CC[C@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−1.6
± 0.7
|
| 7640 |
EN300-42154_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CS(=O)(=O)C5CCCC5 |
−1.6
± 0.3
|
| 7641 |
ALP-UNI-3496895b-5_7
|
|
C[C@@H]1C[N@](CC[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−1.6
± 0.3
|
| 7642 |
ALP-POS-5bb456a5-1_5
|
|
C[C@@H]1C[N@@](CC[C@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−1.6
± 0.3
|
| 7643 |
MAK-UNK-83e0a0b4-4_2
|
|
CCCCc1ccc2c(c1)[C@H](CCO2)C(=O)N(CCNC3C[NH2+]C3)c4cncc5c4cccc5 |
−1.6
± 0.8
|
| 7644 |
MAK-UNK-c749d764-33_5
|
|
CS(=O)(=O)N(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@@H]([C@H]3O)C(F)F |
−1.5
± 0.4
|
| 7645 |
ALP-POS-5bb456a5-2_2
|
|
C[C@H]1C[N@@](CC[C@@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−1.5
± 0.4
|
| 7646 |
EN300-28177_2_3_1 |
|
C[C@@H](C(=O)N1CCC[C@H](C1)C(=O)N)OC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−1.4
± 0.3
|
| 7647 |
MAK-UNK-c749d764-33_2
|
|
CS(=O)(=O)N(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−1.3
± 0.6
|
| 7648 |
MAK-UNK-c749d764-10_2
|
|
CSN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−1.2
± 0.4
|
| 7649 |
EN300-52983_1_2_1 |
|
CN1C[C@H](CCC1=O)C(=O)N[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−1.1
± 0.3
|
| 7650 |
LON-WEI-5e7d1b3e-56_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)Nc3ccsc3C(=O)OC |
−1.1
± 0.5
|
| 7651 |
EN300-36845_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CNC(=O)C5CCCC5 |
−1.1
± 0.2
|
| 7652 |
MAK-UNK-c749d764-19_2
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−1.0
± 0.5
|
| 7653 |
ALP-POS-5bb456a5-1_15
|
|
C[C@@H]1C[N@](CC[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−0.9
± 0.3
|
| 7654 |
LON-WEI-4d77710c-35_2
|
|
Cc1ccc(cc1)C[N@H+]2CC[C@@H](C2)CNC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
−0.9
± 0.7
|
| 7655 |
EN300-385132_1_1_2 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)C[C@@H]5[NH2+][NH2+][C@H](N5)C6CCOCC6 |
−0.9
± 0.6
|
| 7656 |
EN300-90225_1_1_1 |
|
C[N@H+]1[NH2+]N[C@H](N1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−0.9
± 0.3
|
| 7657 |
EDJ-MED-4c7486ba-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)Cc5cnc[nH]5 |
−0.9
± 0.2
|
| 7658 |
MAK-UNK-c749d764-21_1
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−0.9
± 0.5
|
| 7659 |
ALP-UNI-0676e700-29_1
|
|
CS(=O)(=O)c1ccc(cn1)C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−0.8
± 0.2
|
| 7660 |
LON-WEI-4d77710c-60_1
|
|
CC1CC[NH+](CC1)CCCNC(=O)Nc2cn(c(=O)c3c2cccc3)CC(C)C |
−0.7
± 0.7
|
| 7661 |
MAK-UNK-8be7dca9-10_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[C@@H](Oc4c3cc(cc4)Cl)C(=O)[O-] |
−0.7
± 0.3
|
| 7662 |
EN300-51889_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)CCC(=O)N5CCC(CC5)O |
−0.7
± 0.2
|
| 7663 |
ALP-POS-2da19ca7-7_7
|
|
C[C@@H]1C[N@](CC[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−0.6
± 0.3
|
| 7664 |
LON-WEI-4d77710c-33_1
|
|
C[C@@H]1c2cc(c(cc2CCN1C(=O)Nc3cn(c(=O)c4c3cccc4)C)OC)OC |
−0.6
± 0.4
|
| 7665 |
MAK-UNK-c749d764-21_7
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−0.6
± 0.4
|
| 7666 |
EN300-746187_1_2_4 |
|
C[C@@H]1[NH2+][N@@H+]2C[C@H](CC[C@@H]2N1)C(=O)N[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−0.6
± 0.7
|
| 7667 |
ALP-POS-5bb456a5-2_8
|
|
C[C@H]1C[N@](CC[C@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−0.3
± 0.4
|
| 7668 |
MAK-UNK-c749d764-18_8
|
|
CC(C)SCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@H]([C@H]3O)C(F)F |
−0.3
± 0.5
|
| 7669 |
ALP-UNI-0676e700-6_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc(cn5)c6n[n-]nn6 |
−0.2
± 0.3
|
| 7670 |
MAK-UNK-83e0a0b4-2_2
|
|
c1cc2c(cc1CN3CC[NH2+]CC3)cncc2N(CCNC4C[NH2+]C4)C(=O)[C@H]5CCOc6c5cc(cc6)Cl |
−0.0
± 0.6
|
| 7671 |
LON-WEI-5e7d1b3e-33_1
|
|
C[C@@H]1c2cc(c(cc2CCN1C(=O)Nc3cn(c(=O)c4c3cccc4)C)OC)OC |
0.0
± 0.4
|
| 7672 |
MAK-UNK-c749d764-19_8
|
|
c1ccc2c(c1)cncc2N(C[NH3+])C(=O)C[C@H]3CCC[C@H]([C@H]3O)C(F)F |
0.1
± 0.4
|
| 7673 |
MAT-POS-2492181e-9_1
|
|
CC1CC[NH+](CC1)Cc2ccc(cc2)NC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
0.1
± 0.7
|
| 7674 |
EDJ-MED-4c7486ba-10_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@H]5COCC[N@]5CC(F)(F)F |
0.3
± 0.2
|
| 7675 |
MAT-POS-2492181e-8_1
|
|
CC1CCN(CC1)c2ccc(cc2)NC(=O)Nc3cn(c(=O)c4c3cccc4)CC(C)C |
0.3
± 0.7
|
| 7676 |
MAK-UNK-c749d764-20_2
|
|
CCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
0.4
± 0.4
|
| 7677 |
MAT-POS-2905de8c-3_2
|
|
C[NH+](C)[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
0.5
± 0.2
|
| 7678 |
MAK-UNK-c749d764-21_2
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
0.7
± 0.6
|
| 7679 |
RAL-THA-8416115c-7_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)CC(=O)[O-] |
0.7
± 0.4
|
| 7680 |
EDJ-MED-4c7486ba-4_1
|
|
C[NH+](C)CC(=O)NC[C@@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
0.8
± 0.2
|
| 7681 |
RAL-THA-8416115c-7_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)CC(=O)[O-] |
0.9
± 0.4
|
| 7682 |
ALP-POS-5bb456a5-1_2
|
|
C[C@H]1C[N@@](CC[C@@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
0.9
± 0.5
|
| 7683 |
EDJ-MED-4c7486ba-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]c5S(=O)(=O)N |
1.0
± 0.2
|
| 7684 |
RAL-THA-8416115c-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5n[n-]nn5 |
1.2
± 0.3
|
| 7685 |
EN300-107740_1_1_3 |
|
C[C@@H]1N[NH2+][N@H+](N1)CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
1.5
± 0.5
|
| 7686 |
MAK-UNK-83e0a0b4-1_2
|
|
CCCCc1ccc2c(c1)[C@H](CCO2)C(=O)N(CCNC3C[NH2+]C3)c4cncc5c4ccc(c5)CN6CC[NH2+]CC6 |
1.5
± 0.8
|
| 7687 |
EN300-90225_1_1_2 |
|
C[N@H+]1[NH2+]N[C@@H](N1)CO[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
1.8
± 0.2
|
| 7688 |
EN300-299390_2_1_1 |
|
COC[C@H]1[NH2+][NH2+][C@H](N1)CNC(=O)CC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
1.9
± 0.9
|
| 7689 |
RAL-THA-8416115c-12_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5n[n-]nn5 |
1.9
± 0.5
|
| 7690 |
ALP-UNI-0676e700-17_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5ccc(nc5)c6n[n-]nn6 |
2.1
± 0.3
|
| 7691 |
LEE-CAM-7ab9b158-1_2
|
|
C[NH+](C)[C@H]1COC[C@@H]1OC[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
2.7
± 0.4
|
| 7692 |
EN300-1653482_2_1_1 |
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CNC(=O)[C@@H]5CC[N@]6[C@@H](C5)N[NH2+][NH2+]6 |
3.6
± 0.8
|
| 7693 |
ALP-POS-5bb456a5-1_16
|
|
C[C@H]1C[N@](CC[C@H]1NC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
3.6
± 0.4
|
| 7694 |
EN300-1726073_2_1_1 |
|
Cn1c(cnn1)C(C(=O)NC[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)(F)F |
5.9
± 0.3
|
| 7695 |
EN300-107740_1_1_2 |
|
C[C@H]1N[NH2+][N@@H+](N1)CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
9.7
± 0.6
|
| 7696 |
EN300-77343_1_1_1 |
|
C[C@@H]1N[NH2+][NH2+][N@]1CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
13.8
± 0.5
|
| 7697 |
EN300-107740_1_1_1 |
|
C[C@@H]1N[NH2+][N@@H+](N1)CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
15.0
± 0.5
|
| 7698 |
EN300-77343_1_1_2 |
|
C[C@H]1N[NH2+][NH2+][N@]1CCNC(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
23.2
± 0.5
|