Molecular Properties | |
SMILES: | CS(=O)(=O)CCCN[C@@]1(C(=O)Nc2cncc3ccccc23)CCOc2ccc(Cl)cc21 |
MW: | 473.12 |
Fraction sp3: | 0.3 |
HBA: | 6 |
HBD: | 2 |
Rotatable Bonds: | 7 |
TPSA: | 97.39 |
cLogP: | 3.53 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-02-28 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Aliphatic long chain
Long aliphatic chain
EDJ-MED-6d9ff7d0-9
0.889
EDJ-MED-6d9ff7d0-4
0.802
EDJ-MED-6d9ff7d0-1
0.768
EDG-MED-90036822-86
0.713
MAT-POS-2905de8c-2
0.702
EDJ-MED-6d9ff7d0-5
0.702
EDJ-MED-6d9ff7d0-2
0.702
EDJ-MED-6d9ff7d0-6
0.676
EDJ-MED-6d9ff7d0-3
0.676
EDJ-MED-6d9ff7d0-8
0.670
EDJ-MED-6d9ff7d0-7
0.667
EDG-MED-90036822-13
0.667
EDG-MED-90036822-2
0.660
EDJ-MED-15e90dfc-7
0.657
EDG-MED-90036822-63
0.653
EDG-MED-90036822-28
0.653
EDG-MED-90036822-29
0.653
EDG-MED-90036822-100
0.653
EDG-MED-90036822-9
0.650
EDG-MED-90036822-21
0.650
EDG-MED-90036822-34
0.650
EDG-MED-90036822-62
0.644
EDG-MED-90036822-11
0.641
EDG-MED-90036822-10
0.641
EDG-MED-90036822-61
0.638
PET-UNK-3bb57da2-1
0.635
PET-UNK-4880b143-1
0.632
EDG-MED-90036822-24
0.631
EDG-MED-90036822-4
0.629
EDG-MED-90036822-5
0.629
EDG-MED-90036822-16
0.629
EDG-MED-90036822-48
0.629
EDG-MED-90036822-56
0.629
EDG-MED-90036822-3
0.629
EDG-MED-90036822-15
0.629
EDG-MED-90036822-17
0.629
EDG-MED-90036822-44
0.629
EDG-MED-90036822-47
0.629
EDJ-MED-6864a934-1
0.626
EDG-MED-90036822-80
0.623
EDG-MED-90036822-33
0.623
RAL-THA-e002e396-1
0.621
EDG-MED-90036822-68
0.620
EDG-MED-90036822-87
0.620
EDJ-MED-6864a934-10
0.617
EDG-MED-90036822-37
0.617
EDG-MED-90036822-84
0.617
MAT-POS-e6dd326d-4
0.615
EDG-MED-90036822-102
0.615
EDG-MED-90036822-76
0.609
EDG-MED-90036822-77
0.609
ALP-POS-e4f7337d-1
0.607
EDG-MED-90036822-59
0.606
PET-UNK-5d7c542f-3
0.606
EDG-MED-90036822-51
0.606
EDG-MED-90036822-58
0.606
EDG-MED-90036822-43
0.604
EDG-MED-90036822-79
0.604
EDG-MED-90036822-25
0.602
EDG-MED-90036822-52
0.602
EDG-MED-90036822-107
0.600
EDG-MED-971238d3-11
0.600
EDG-MED-90036822-53
0.598
EDG-MED-90036822-60
0.598
EDG-MED-90036822-103
0.598
EDG-MED-90036822-64
0.596
PET-UNK-e5587e5d-1
0.596
EDG-MED-90036822-66
0.596
EDG-MED-90036822-72
0.596
PET-UNK-824b5c6a-1
0.596
MAT-POS-2905de8c-3
0.596
MAT-POS-8e4737f4-1
0.596
DAR-DIA-6a508060-10
0.596
EDJ-MED-e4b030d8-13
0.596
BEN-DND-a7517465-4
0.596
EDG-MED-90036822-96
0.595
VLA-UCB-34f3ed0c-4
0.595
EDG-MED-90036822-18
0.595
EDG-MED-90036822-57
0.595
EDG-MED-90036822-106
0.595
PET-UNK-3bb57da2-3
0.594
EDG-MED-90036822-93
0.593
EDG-MED-90036822-31
0.593
EDG-MED-90036822-65
0.593
EDG-MED-90036822-110
0.593
PET-UNK-3bb57da2-2
0.593
PET-UNK-5d7c542f-4
0.593
MAT-POS-e6dd326d-2
0.592
MAT-POS-45b13633-2
0.592
EDG-MED-90036822-38
0.591
EDG-MED-90036822-32
0.591
RAL-THA-e002e396-2
0.590
RAL-THA-e002e396-11
0.590
EDG-MED-90036822-101
0.589
EDG-MED-90036822-83
0.589
EDG-MED-90036822-49
0.589
EDG-MED-90036822-94
0.589
EDG-MED-0e5afe9d-3
0.588
EDJ-MED-d08626de-1
0.588
PET-UNK-29afea89-2
0.588