| Rank |
Microstate |
SMILES |
ΔG / kcal M-1 |
| 1601 |
RAL-THA-1d44ff04-6_1
|
|
COC(=O)NCc1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3 |
−7.3
± 0.5
|
| 1602 |
MIC-UNK-0a05c952-1_2
|
|
c1ccc2c(c1)cncc2N3[C@H](C[C@@H](C3=O)c4cccc(c4)Cl)[C@@H]5CO5 |
−7.3
± 0.2
|
| 1603 |
MAK-UNK-8be7dca9-9_1
|
|
c1cc2c(cc1C(=O)[O-])cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.3
± 0.3
|
| 1604 |
MAT-POS-b5746674-104_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)N3CCC4(CC3)OCCO4 |
−7.3
± 0.1
|
| 1605 |
ALP-POS-e0fe77e5-1_1
|
|
c1ccc2c(c1)cncc2N3CCC[C@@H](C3=O)c4ccc(c(c4)Cl)Cl |
−7.3
± 0.5
|
| 1606 |
EDJ-MED-c82a5324-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3C[N@@H+](Cc4c3cc(cc4)Cl)CC(=O)NC5COC5 |
−7.3
± 0.2
|
| 1607 |
JAG-UCB-f37eaa14-7_1
|
|
CC([C@]1(C[C@@H](C1)[N@]2c3c(cc(cc3)Cl)[C@@]4(C2)C(=O)N(CC4)c5c6c(cnc5)cccc6)O)C |
−7.3
± 0.2
|
| 1608 |
DAR-DIA-0d514e7d-26_1
|
|
C[C@@H]1COc2c(cc(cc2OC)Cl)[C@]1(C)C(=O)Nc3cncc4c3cccc4 |
−7.3
± 0.2
|
| 1609 |
MIC-UNK-cdc2493e-14_4
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)[C@H]4CC[C@H](C4)[NH+]5CCCCC5 |
−7.3
± 0.3
|
| 1610 |
PET-UNK-8c422e11-1_1
|
|
CC(c1cc(cc(c1)Cl)CC(=O)Nc2cncc3c2cccc3)(F)F |
−7.3
± 0.4
|
| 1611 |
EDG-MED-90036822-55_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)c5ccc(nc5)N6CC(C6)[NH3+] |
−7.3
± 0.4
|
| 1612 |
MAK-UNK-c749d764-25_3
|
|
COC(=O)N(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@@H]3O)C(F)F |
−7.3
± 0.3
|
| 1613 |
MIC-UNK-d854bf4c-1_2
|
|
CC(=O)N1CCC2(CC1)CN(C(=O)[C@H]2c3cccc(c3)Cl)c4cncc5c4cccc5 |
−7.3
± 0.3
|
| 1614 |
ROB-UNI-322e8f70-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3c4cc(ccc4NC(=O)N3)Cl |
−7.3
± 0.1
|
| 1615 |
FRA-DIA-b66f7109-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3COc4c3cc(cc4Cl)O[C@@H]5CC(=O)N5 |
−7.3
± 0.4
|
| 1616 |
MAT-POS-fce787c2-5_1
|
|
C[NH2+][C@@H](c1ccc(c(c1)Cl)Cl)C(=O)Nc2cncc3c2cccc3 |
−7.26
± 0.10
|
| 1617 |
MIC-UNK-02d7a284-3_1
|
|
CC(=O)NC[C@@H]1CN(CC(=O)N1c2cccc(c2)Cl)C(=O)c3cncc4c3cccc4 |
−7.3
± 0.1
|
| 1618 |
DAR-DIA-23e5a6a0-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4O[C@@H]5CC6(CC6)C[NH2+]5)Cl |
−7.3
± 0.3
|
| 1619 |
ALP-POS-fe871b40-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCNc4c3cc(cc4C#N)Cl |
−7.25
± 0.09
|
| 1620 |
MAT-POS-a13804f0-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)NC(=O)[C@@H]4CC[C@@H](O4)C(=O)N5CCCC5 |
−7.25
± 0.09
|
| 1621 |
MAT-POS-932d1078-4_1
|
|
COC[C@@]1(CCOc2c1cc(c(c2)Cl)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.25
± 0.10
|
| 1622 |
RAL-THA-2d450e86-7_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3ccc(cc3)F |
−7.25
± 0.10
|
| 1623 |
PET-UNK-83d689b6-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCc5nncs5 |
−7.25
± 0.08
|
| 1624 |
LON-WEI-5e7d1b3e-28_1
|
|
CC(C)Cn1cc(c2ccccc2c1=O)NC(=O)NCc3cc(ccc3OC)OC |
−7.2
± 0.2
|
| 1625 |
ALP-UNI-8e43a71e-5_4
|
|
C[C@H]1C[N@](CC[C@@H]1NC(=O)C[C@@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−7.2
± 0.1
|
| 1626 |
VLA-UNK-56836b69-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CC(=O)Nc4c3cc(c(c4)Cl)Cl |
−7.2
± 0.3
|
| 1627 |
PET-UNK-c5865d42-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)C[C@H]4CC[NH2+]4 |
−7.2
± 0.3
|
| 1628 |
RAL-THA-05e671eb-20_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4C#N)Cl |
−7.2
± 0.4
|
| 1629 |
ALP-POS-fe871b40-15_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CC(=O)Nc4c3cc(c(c4)F)Cl |
−7.2
± 0.2
|
| 1630 |
EDJ-MED-1981ceba-4_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)N5CC(C5)C#N |
−7.2
± 0.3
|
| 1631 |
VLA-UCB-34f3ed0c-20_1
|
|
c1ccc2c(c1)cncc2N(C(=O)c3cnc[nH]3)C(=O)[C@@H]4CCOc5c4cc(cc5)Cl |
−7.2
± 0.3
|
| 1632 |
EDJ-MED-841e0cf0-5_4
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@H]3C[N@](Cc4c3cc(cc4)Cl)S(=O)(=O)C5CC5 |
−7.2
± 0.2
|
| 1633 |
LAU-MED-88a3970a-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCOc4c3cc(cc4CCS(=O)(=O)N)Cl |
−7.2
± 0.3
|
| 1634 |
EDJ-MED-d1555997-2_1
|
|
Cc1cccc2c1c(cnc2)NC(=O)[C@@H]3C[N@@](Cc4c3cc(cc4)Cl)S(=O)(=O)C |
−7.2
± 0.3
|
| 1635 |
MAK-UNK-c749d764-24_7
|
|
CCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−7.2
± 0.4
|
| 1636 |
LON-WEI-5e7d1b3e-33_1
|
|
C[C@@H]1c2cc(c(cc2CCN1C(=O)Nc3cn(c(=O)c4c3cccc4)C)OC)OC |
−7.2
± 0.4
|
| 1637 |
EDG-MED-90036822-60_1
|
|
C[C@@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)n5ccnc5 |
−7.2
± 0.2
|
| 1638 |
EDJ-MED-ee07cf00-12_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)COc4ccc(cc4)C(=O)N |
−7.23
± 0.09
|
| 1639 |
EDG-MED-90036822-90_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](c5ccccc5F)[NH3+] |
−7.2
± 0.3
|
| 1640 |
EDJ-MED-670ad2ee-7_2
|
|
CN(C)S(=O)(=O)[N@]1Cc2ccc(cc2[C@@H](C1)C(=O)Nc3cncc4c3cc(cc4)F)Cl |
−7.2
± 0.3
|
| 1641 |
RAL-THA-2d450e86-13_1
|
|
Cc1cccc(c1)CC(=O)Nc2cncc3c2cccc3 |
−7.23
± 0.10
|
| 1642 |
MAT-POS-24589f88-1_1
|
|
COc1ccc2cncc(c2c1)NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)OC |
−7.23
± 0.09
|
| 1643 |
ALP-UNI-76695c4f-10_1
|
|
C[C@]12CN(C[C@]1(C(=O)NC2=O)C)C(=O)C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.2
± 0.4
|
| 1644 |
PET-UNK-83d689b6-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCCc5cccnn5 |
−7.23
± 0.07
|
| 1645 |
EDJ-MED-ee07cf00-4_1
|
|
C[C@@H](C(=O)N[C@@H](c1cccc(c1)Cl)C(=O)Nc2cncc3c2cccc3)NC(=O)C4CCC4 |
−7.23
± 0.09
|
| 1646 |
VLA-UCB-1dbca3b4-10_1
|
|
c1ccc2c(c1)cncc2N3C(=O)CC[C@@H](C3=O)c4cccc(c4)Cl |
−7.2
± 0.4
|
| 1647 |
LEE-CAM-7ab9b158-4_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)COC[C@H]5CN6C[C@@H](O5)CCC6=O |
−7.2
± 0.4
|
| 1648 |
ERI-UCB-d6de1f3c-5_2
|
|
c1ccc2c(c1)cncc2C(=O)N3C[C@H](N(C(=O)C3)c4cccc(c4)Cl)CC5CCCCC5 |
−7.2
± 0.3
|
| 1649 |
ALP-POS-347519b5-1_47
|
|
CS(=O)(=O)[N@@]1C[C@H]2[C@H]3CC[C@H](C3)[C@@H]2[C@H](C1)C(=O)Nc4cncc5c4cccc5 |
−7.2
± 0.2
|
| 1650 |
DAR-DIA-9e4459de-11_11
|
|
c1cc2c(c(c1)NCOCCOCCOc3ccc4c(c3)cncc4NC(=O)[C@H]5CCOc6c5cc(cc6)Cl)c(n(c2O)[C@@H]7CCC(=O)NC7=O)O |
−7.2
± 0.1
|
| 1651 |
JOH-SUS-a69c159d-4_1
|
|
c1ccc2c(c1)c(cnc2C(F)(F)F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.2
± 0.3
|
| 1652 |
EDG-MED-70ae9412-2_2
|
|
C[NH+](C)CC(=O)NC[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.22
± 0.10
|
| 1653 |
VLA-UNK-db5e3064-1_1
|
|
c1ccc2c(c1)cncc2N3C(=O)CO[C@@H](C3=O)c4cccc(c4)Cl |
−7.2
± 0.3
|
| 1654 |
VLA-UNK-ba665ac8-2_2
|
|
C[N@H+]1CC(=O)N(C(=O)[C@@]12CCOc3c2cc(cc3)Cl)c4cncc5c4cccc5 |
−7.2
± 0.2
|
| 1655 |
MIC-UNK-67d4a29a-3_1
|
|
Cc1cccc2c1c(cnc2)N(C)C(=O)Cc3cccc(c3)Cl |
−7.2
± 0.2
|
| 1656 |
BEN-BAS-5c03e89e-2_4
|
|
CC(C)([C@H]1C=Nc2ccc(cc2[C@H]1C(=O)Nc3cncc4c3cccc4)Cl)O |
−7.2
± 0.4
|
| 1657 |
RAL-THA-2d450e86-25_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(ccc3F)Cl |
−7.2
± 0.4
|
| 1658 |
PET-UNK-9b23ef84-11_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CN(Cc4c3cc(cc4)Cl)c5ncno5 |
−7.2
± 0.3
|
| 1659 |
MAK-UNK-c749d764-20_2
|
|
CCCN(c1cncc2c1cccc2)C(=O)C[C@H]3CCC[C@@H]([C@@H]3O)C(F)F |
−7.2
± 0.2
|
| 1660 |
JOH-UNI-ea1df7a8-1_1
|
|
c1ccc2c(c1)cncc2CC(=O)N3CCOc4c3cc(cc4)Cl |
−7.21
± 0.10
|
| 1661 |
KAD-UNI-80f122c8-5_4
|
|
C[N@@](C1CCN(CC1)C(=O)C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5)S(=O)(=O)C |
−7.2
± 0.2
|
| 1662 |
RAL-THA-8416115c-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5n[n-]nn5 |
−7.2
± 0.3
|
| 1663 |
EDG-MED-ba1ac7b9-4_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CC(C5)[N@@H+]6CC[C@@H](C6)O |
−7.2
± 0.5
|
| 1664 |
ED_-GRI-5b13fbe2-48_2
|
|
C[C@H](C[NH2+]CCO[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)O |
−7.2
± 0.4
|
| 1665 |
EDG-MED-90036822-5_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@@H](CF)[NH3+] |
−7.2
± 0.3
|
| 1666 |
PET-UNK-689df078-1_1
|
|
c1ccc2c(c1)cncc2N3C(=O)CC[C@H](C3=O)c4cccc(c4)Cl |
−7.2
± 0.2
|
| 1667 |
RAL-THA-8416115c-13_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5[nH]ncn5 |
−7.20
± 0.09
|
| 1668 |
PET-UNK-1320d94d-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)[C@@H]4CC[C@@H](O4)C(=O)N5CCOCC5 |
−7.2
± 0.2
|
| 1669 |
JAG-UCB-f37eaa14-6_1
|
|
c1ccc2c(c1)cncc2N3CC[C@@]4(C3=O)C[N@@](c5c4cc(cc5)Cl)[C@@H]6CC(=O)N6 |
−7.2
± 0.2
|
| 1670 |
EDJ-MED-8c98ee63-2_2
|
|
Cn1ccc(n1)C[NH2+]C[C@]2(CCOc3c2cc(cc3)Cl)C(=O)Nc4cncc5c4cccc5 |
−7.20
± 0.06
|
| 1671 |
MIC-UNK-b9827f26-1_1
|
|
c1ccc2c(c1)cncc2C(=O)N3CCN(C(=O)C3)c4ccc(c(c4)Cl)Cl |
−7.2
± 0.2
|
| 1672 |
EDJ-MED-cf4b0d25-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H](c3cccc(c3)Cl)NC(=O)[C@@H]4CCCO4 |
−7.20
± 0.09
|
| 1673 |
VLA-UNK-f702bf1c-4_1
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)N(C3=O)C[C@@H]6CC(=O)NC6 |
−7.2
± 0.3
|
| 1674 |
DAR-DIA-0d514e7d-9_1
|
|
C[C@H]1COc2c(cc(cc2[C@@H]1C(=O)Nc3cncc4c3cccc4)Cl)c5ccccc5 |
−7.2
± 0.2
|
| 1675 |
EDJ-MED-1981ceba-3_3
|
|
COC1CN(C1)S(=O)(=O)[N@@]2Cc3ccc(cc3[C@H](C2)C(=O)Nc4cncc5c4cccc5)Cl |
−7.2
± 0.3
|
| 1676 |
MIC-UNK-5a93dd5f-12_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)[N@@]4CC[C@@H](C4)[NH+]5CCCCC5 |
−7.2
± 0.3
|
| 1677 |
BEN-BAS-c2bc0d80-1_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CC=Nc4c3cc(cc4)Cl |
−7.2
± 0.3
|
| 1678 |
JOH-SUS-a69c159d-7_1
|
|
c1cc2c(cc1F)c(c(nc2F)F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.2
± 0.4
|
| 1679 |
KAD-UNI-877d7bed-16_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@H]3CCOc4c3cc(cc4OCCn5c(ccc5O)O)Cl |
−7.2
± 0.2
|
| 1680 |
PET-UNK-2c6614b6-6_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCS(=O)(=O)c4c3cc(cc4)Cl |
−7.2
± 0.2
|
| 1681 |
MIC-UNK-5a93dd5f-9_1
|
|
CN(C)[C@@H]1CC[N@@H+](C1)[C@@H](c2cccc(c2)Cl)C(=O)Nc3cncc4c3cccc4 |
−7.2
± 0.3
|
| 1682 |
DAR-DIA-0cde14eb-58_1
|
|
C[C@@H](c1cccc(c1)C2(CC2)I)C(=O)Nc3cncc4c3cccc4 |
−7.2
± 0.5
|
| 1683 |
MAT-POS-5f1400cf-1_6
|
|
Cn1cc(cn1)N2CC[C@@H](C2)C[NH2+]C[C@]3(CCOc4c3cc(cc4)Cl)C(=O)Nc5cncc6c5cccc6 |
−7.19
± 0.09
|
| 1684 |
MAK-UNK-c749d764-21_7
|
|
CCCCN(c1cncc2c1cccc2)C(=O)C[C@@H]3CCC[C@H]([C@H]3O)C(F)F |
−7.2
± 0.2
|
| 1685 |
ALP-POS-347519b5-1_61
|
|
CS(=O)(=O)[N@@]1C[C@@H]2[C@H]3CC[C@H](C3)[C@H]2[C@H](C1)C(=O)Nc4cncc5c4cccc5 |
−7.2
± 0.1
|
| 1686 |
EDJ-MED-d203f206-10_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)CC(=O)N5CCCC6(C5)[C@@H](C[C@@H]6O)O |
−7.2
± 0.3
|
| 1687 |
ALP-UNI-dbbfd3db-15_2
|
|
C[C@H](C(=O)N[C@]1(CCOc2c1cc(cc2)Cl)C(=O)Nc3cncc4c3cccc4)NC(=O)C5CCC5 |
−7.2
± 0.3
|
| 1688 |
RAL-THA-1d44ff04-8_1
|
|
c1ccc2c(c1)cncc2NC(=O)Cc3cc(cc(c3)Cl)c4[nH]ncn4 |
−7.19
± 0.10
|
| 1689 |
BEN-BAS-c2bc0d80-4_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CC=Nc4c3[nH]c(cc4=O)Cl |
−7.2
± 0.2
|
| 1690 |
MIC-UNK-5a93dd5f-2_6
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H](c3cccc(c3)Cl)[NH+]4C[C@@H]5CCCC[C@H]5C4 |
−7.2
± 0.3
|
| 1691 |
LAU-MED-88a3970a-17_1
|
|
CNC(=O)CCc1cc(cc2c1OCC[C@H]2C(=O)Nc3cncc4c3cccc4)Cl |
−7.2
± 0.6
|
| 1692 |
EDG-MED-90036822-99_4
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)NC(=O)[C@H]([C@H](C5CCC5)O)F |
−7.2
± 0.3
|
| 1693 |
EDJ-MED-6d9ff7d0-3_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)[NH2+]Cc5ccn[nH]5 |
−7.2
± 0.1
|
| 1694 |
ALP-UNI-b33a865d-1_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@H]3CCN(c4c3cc(cc4)Cl)Cc5cnc[nH]5 |
−7.18
± 0.09
|
| 1695 |
MAT-POS-3b97339c-3_2
|
|
c1ccc2c(c1)cncc2NC(=O)[C@]3(CCOc4c3cc(cc4)Cl)CNC(=O)c5cn[nH]c5S(=O)(=O)N |
−7.2
± 0.2
|
| 1696 |
PET-UNK-acd70dee-2_1
|
|
c1ccc2c(c1)cncc2NC(=O)[C@@]3(CCOc4c3cc(cc4)Cl)OCc5ncco5 |
−7.2
± 0.2
|
| 1697 |
VLA-UNK-c65c1026-2_1
|
|
c1ccc2c(c1)cncc2N3C(=O)CC[C@@]4(C3=O)COc5c4cc(cc5)Cl |
−7.2
± 0.2
|
| 1698 |
VLA-UNK-f702bf1c-7_1
|
|
c1ccc2c(c1)cncc2N3C(=O)[C@@]4(CCOc5c4cc(cc5)Cl)N(C3=O)CCN6CC[NH2+]CC6 |
−7.2
± 0.3
|
| 1699 |
MIC-UNK-cdc2493e-4_3
|
|
c1ccc2c(c1)cncc2NC(=O)N(c3cccc(c3)Cl)C4C[C@@H]5CCC[C@H]5C4 |
−7.2
± 0.4
|
| 1700 |
ALP-POS-ce760d3f-7_1
|
|
c1cc2cncc(c2cc1F)NC(=O)[C@@H]3CCOc4c3cc(cc4)Cl |
−7.2
± 0.4
|