Molecular Properties | |
SMILES: | CC(C)(C)c1ccc(N(C(=O)c2cocn2)C(C(=O)NC2COC2)c2cccnc2)cc1 |
MW: | 434.2 |
Fraction sp3: | 0.33 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 97.56 |
cLogP: | 3.27 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 4.07098207587998 |
Order Status | |
Shipped: | synthesis in progress |
Oxetanes, thietanes
ALP-POS-88a7a97e-12
0.850
ALP-POS-88a7a97e-45
0.840
ALP-POS-88a7a97e-30
0.835
ALP-POS-88a7a97e-28
0.819
ALP-POS-88a7a97e-9
0.802
ALP-POS-88a7a97e-39
0.791
ALP-POS-88a7a97e-15
0.764
ALP-POS-88a7a97e-1
0.753
ALP-POS-88a7a97e-14
0.744
ALP-POS-88a7a97e-43
0.739
ALP-POS-88a7a97e-18
0.735
ALP-POS-88a7a97e-35
0.726
ALP-POS-88a7a97e-7
0.726
ALP-POS-88a7a97e-26
0.725
ALP-POS-88a7a97e-6
0.723
ALP-POS-88a7a97e-31
0.705
ALP-POS-88a7a97e-33
0.701
ALP-POS-88a7a97e-10
0.701
ALP-POS-88a7a97e-2
0.701
ALP-POS-88a7a97e-22
0.701
ALP-POS-88a7a97e-32
0.697
ALP-POS-88a7a97e-16
0.693
ALP-POS-88a7a97e-25
0.687
ALP-POS-88a7a97e-3
0.678
ALP-POS-88a7a97e-4
0.678
ALP-POS-88a7a97e-29
0.678
ALP-POS-88a7a97e-38
0.678
ALP-POS-88a7a97e-46
0.678
ALP-POS-88a7a97e-5
0.670
ALP-POS-88a7a97e-36
0.663
ALP-POS-88a7a97e-27
0.663
ALP-POS-88a7a97e-8
0.663
ALP-POS-88a7a97e-23
0.660
ALP-POS-88a7a97e-24
0.660
ALP-POS-88a7a97e-37
0.660
ALP-POS-88a7a97e-40
0.660
ALP-POS-88a7a97e-11
0.660
ALP-POS-88a7a97e-47
0.656
ALP-POS-88a7a97e-17
0.656
ALP-POS-88a7a97e-19
0.656
ALP-POS-88a7a97e-13
0.649
ALP-POS-88a7a97e-48
0.642
ALP-POS-88a7a97e-41
0.635
ALP-POS-42f3de95-2
0.635
ALP-POS-88a7a97e-21
0.629
ALP-POS-88a7a97e-42
0.629
ALP-POS-42f3de95-1
0.629
ALP-POS-88a7a97e-44
0.626
ALP-POS-02c6a514-50
0.622
BRU-THA-40a53a3c-1
0.594
ALP-POS-88a7a97e-49
0.592
ALP-POS-88a7a97e-20
0.565
ALP-POS-42f3de95-3
0.557
ALP-UNI-fe744232-18
0.548
ALP-POS-95f71980-36
0.547
ALP-POS-ced8ea4d-62
0.542
LON-WEI-adc59df6-14
0.527
LON-WEI-adc59df6-44
0.522
LON-WEI-adc59df6-35
0.516
ALP-POS-84f19ead-2
0.515
LON-WEI-adc59df6-39
0.510
ALP-POS-ced8ea4d-32
0.509
LON-WEI-adc59df6-8
0.505
ALP-POS-ced8ea4d-27
0.505
ALP-UNI-fe744232-10
0.505
LON-WEI-adc59df6-19
0.500
ALP-POS-ced8ea4d-28
0.500
ALP-UNI-fe744232-16
0.500
ALP-UNI-fe744232-24
0.500
ALP-UNI-fe744232-13
0.496
ALP-UNI-fe744232-22
0.495
ALP-POS-ced8ea4d-9
0.495
ALP-UNI-fe744232-5
0.495
ALP-POS-d0876c20-5
0.495
ALP-POS-ced8ea4d-17
0.491
ALP-POS-ced8ea4d-16
0.491
ALP-UNI-fe744232-17
0.491
ALP-POS-ced8ea4d-51
0.491
ALP-UNI-fe744232-9
0.491
ALP-POS-ced8ea4d-19
0.491
ALP-UNI-fe744232-6
0.491
ALP-UNI-fe744232-7
0.491
ALP-UNI-fe744232-27
0.491
ALP-UNI-fe744232-21
0.486
ALP-UNI-fe744232-28
0.486
ALP-POS-ced8ea4d-67
0.486
ALP-UNI-fe744232-3
0.486
ALP-UNI-fe744232-4
0.486
ALP-UNI-fe744232-8
0.486
ALP-UNI-fe744232-20
0.486
ALP-UNI-fe744232-29
0.486
ALP-POS-d0876c20-17
0.486
LON-WEI-adc59df6-30
0.484
ALP-UNI-fe744232-11
0.482
ALP-UNI-fe744232-15
0.482
ALP-POS-ced8ea4d-52
0.482
ALP-POS-ced8ea4d-5
0.482
ALP-POS-ced8ea4d-11
0.482
ALP-UNI-fe744232-14
0.482
ALP-POS-84f19ead-1
0.480