Molecular Properties | |
SMILES: | CS(=O)(=O)CCO[C@@]1(C(=O)Nc2cncc3ccccc23)CCOc2ccc(Cl)cc21 |
MW: | 460.09 |
Fraction sp3: | 0.27 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 94.59 |
cLogP: | 3.57 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-02-28 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Long aliphatic chain
MIC-UNK-d854bf4c-5
MIC-UNK-d854bf4c-1
MIC-UNK-d854bf4c-6
MIC-UNK-d854bf4c-2
MIC-UNK-d854bf4c-8
MIC-UNK-d854bf4c-7
MIC-UNK-d854bf4c-3
MIC-UNK-d854bf4c-4
PET-UNK-3bb57da2-3
PET-UNK-3bb57da2-2
PET-UNK-3bb57da2-4
PET-UNK-3bb57da2-1
MIC-UNK-d58dbb53-3
MIC-UNK-d58dbb53-2
MIC-UNK-d58dbb53-1
PET-UNK-5d7c542f-4
PET-UNK-5d7c542f-2
PET-UNK-5d7c542f-1
PET-UNK-5d7c542f-5
PET-UNK-5d7c542f-3
PET-UNK-49566573-3
PET-UNK-49566573-1
PET-UNK-49566573-4
PET-UNK-49566573-2
PET-UNK-83d689b6-4
PET-UNK-83d689b6-3
PET-UNK-83d689b6-1
PET-UNK-83d689b6-2
PET-UNK-0d6841fa-7
PET-UNK-0d6841fa-6
PET-UNK-0d6841fa-4
PET-UNK-0d6841fa-3
PET-UNK-0d6841fa-2
PET-UNK-0d6841fa-1
PET-UNK-0d6841fa-5
PET-UNK-5d7c542f-4
0.879
PET-UNK-5d7c542f-3
0.871
PET-UNK-3bb57da2-3
0.846
PET-UNK-3bb57da2-1
0.837
PET-UNK-824b5c6a-2
0.826
PET-UNK-5d7c542f-5
0.825
PET-UNK-0cc03aae-3
0.823
RAL-THA-58fba2bc-4
0.815
ED_-GRI-5b13fbe2-72
0.815
EDG-MED-4c68219f-10
0.815
EDG-MED-4c68219f-16
0.809
PET-UNK-0cc03aae-4
0.806
PET-UNK-e5587e5d-1
0.802
PET-UNK-824b5c6a-1
0.793
PET-UNK-0cc03aae-1
0.792
PET-UNK-49566573-1
0.792
ED_-GRI-5b13fbe2-48
0.786
ED_-GRI-5b13fbe2-29
0.786
MIC-UNK-ddc6ad53-2
0.784
MIC-UNK-ddc6ad53-3
0.781
PET-UNK-0cc03aae-5
0.781
PET-UNK-3bb57da2-2
0.781
ED_-GRI-5b13fbe2-30
0.773
PET-UNK-3bb57da2-4
0.768
PET-UNK-0cc03aae-2
0.768
ED_-GRI-5b13fbe2-33
0.768
EDG-MED-4c68219f-6
0.758
EDG-MED-4c68219f-12
0.758
RAL-THA-58fba2bc-2
0.758
MIC-UNK-ddc6ad53-1
0.758
ED_-GRI-5b13fbe2-68
0.753
ED_-GRI-5b13fbe2-59
0.750
CHO-MSK-5891c1ff-3
0.745
ED_-GRI-5b13fbe2-8
0.745
PET-UNK-acd70dee-1
0.745
PET-UNK-83d689b6-3
0.743
PET-UNK-49566573-2
0.743
MIC-UNK-5d22d78d-1
0.742
ED_-GRI-5b13fbe2-62
0.740
ED_-GRI-5b13fbe2-19
0.738
MIC-UNK-5d22d78d-2
0.737
CHO-MSK-5891c1ff-12
0.735
EDJ-MED-28ec730d-5
0.735
ED_-GRI-5b13fbe2-25
0.735
ED_-GRI-5b13fbe2-41
0.735
ED_-GRI-5b13fbe2-40
0.735
ED_-GRI-5b13fbe2-15
0.733
PET-UNK-83d689b6-4
0.728
PET-UNK-acd70dee-5
0.727
ED_-GRI-5b13fbe2-42
0.720
ED_-GRI-5b13fbe2-70
0.720
ED_-GRI-5b13fbe2-71
0.720
ED_-GRI-5b13fbe2-43
0.720
PET-UNK-d9de6a0b-1
0.720
MIC-UNK-5d22d78d-3
0.720
ED_-GRI-5b13fbe2-69
0.720
PET-UNK-83d689b6-1
0.714
PET-UNK-83d689b6-2
0.714
MIC-UNK-5d22d78d-4
0.713
ED_-GRI-5b13fbe2-47
0.713
EDJ-MED-d08626de-1
0.713
PET-UNK-29afea89-2
0.713
EDG-MED-0e5afe9d-3
0.713
EDJ-MED-d08626de-2
0.713
EDG-MED-4c68219f-7
0.712
CHO-MSK-5891c1ff-6
0.710
ED_-GRI-5b13fbe2-56
0.708
PET-UNK-d9de6a0b-2
0.706
PET-UNK-acd70dee-3
0.706
PET-UNK-acd70dee-4
0.706
ED_-GRI-5b13fbe2-34
0.704
ED_-GRI-5b13fbe2-11
0.701
CHO-MSK-5891c1ff-10
0.699
EDG-MED-4c68219f-15
0.699
EDJ-MED-28ec730d-4
0.699
ED_-GRI-5b13fbe2-53
0.699
PET-UNK-acd70dee-2
0.699
EDG-MED-4c68219f-17
0.695
CHO-MSK-5891c1ff-9
0.695
ED_-GRI-5b13fbe2-1
0.694
ED_-GRI-5b13fbe2-12
0.694
CHO-MSK-5891c1ff-8
0.692
ED_-GRI-5b13fbe2-65
0.691
ED_-GRI-5b13fbe2-6
0.688
ED_-GRI-5b13fbe2-57
0.686
PET-UNK-acd70dee-6
0.686
ED_-GRI-5b13fbe2-14
0.686
ED_-GRI-5b13fbe2-39
0.686
MIC-UNK-d58dbb53-1
0.686
EDG-MED-4c68219f-13
0.685
CHO-MSK-5891c1ff-7
0.682
ED_-GRI-5b13fbe2-73
0.682
EDG-MED-4c68219f-8
0.679
ED_-GRI-5b13fbe2-13
0.679
DAR-DIA-e7614d05-1
0.673
DAR-DIA-e7614d05-2
0.673
ALP-POS-93b3621f-1
0.673
DAR-DIA-e7614d05-3
0.673
PET-UNK-bcc8fd08-1
0.673
CHO-MSK-5891c1ff-2
0.673