Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)cc1C)c1cccnc1 |
MW: | 457.574 |
Fraction sp3: | 0.25 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 71.53 |
cLogP: | 5.59512 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine SCR: | Z4438424249 |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.03 |
Order Status | |
Shipped: | 2020-04-27 |
AAR-POS-d2a4d1df-1
LON-WEI-b8d98729-37
0.859
LON-WEI-b8d98729-40
0.784
LON-WEI-b8d98729-8
0.775
LON-WEI-b8d98729-28
0.775
LON-WEI-adc59df6-45
0.775
LON-WEI-adc59df6-16
0.761
LON-WEI-d1c9908a-4
0.758
LON-WEI-adc59df6-12
0.711
LON-WEI-b8d98729-30
0.710
LON-WEI-b8d98729-26
0.710
LON-WEI-d1c9908a-7
0.705
LON-WEI-adc59df6-18
0.689
LON-WEI-b8d98729-43
0.674
LON-WEI-adc59df6-42
0.670
LON-WEI-adc59df6-33
0.656
LON-WEI-b8d98729-1
0.653
LON-WEI-adc59df6-9
0.638
LON-WEI-d1c9908a-9
0.632
LON-WEI-adc59df6-3
0.631
LON-WEI-adc59df6-34
0.621
LON-WEI-adc59df6-37
0.621
RIT-AID-af4ac3d4-1
0.617
LON-WEI-8f408cad-8
0.616
LON-WEI-adc59df6-21
0.609
LON-WEI-adc59df6-44
0.607
LON-WEI-d1c9908a-10
0.604
LON-WEI-adc59df6-30
0.602
LON-WEI-adc59df6-41
0.602
LON-WEI-adc59df6-24
0.602
LON-WEI-b8d98729-27
0.600
LON-WEI-adc59df6-46
0.600
LON-WEI-adc59df6-26
0.598
LON-WEI-adc59df6-5
0.594
LON-WEI-adc59df6-14
0.593
LON-WEI-adc59df6-15
0.588
LON-WEI-adc59df6-27
0.585
LON-WEI-adc59df6-35
0.581
LON-WEI-adc59df6-29
0.576
LON-WEI-adc59df6-31
0.576
LON-WEI-d1c9908a-12
0.571
LON-WEI-adc59df6-8
0.568
LON-WEI-adc59df6-1
0.567
LON-WEI-adc59df6-4
0.564
LON-WEI-adc59df6-43
0.564
LON-WEI-adc59df6-17
0.564
LON-WEI-b8d98729-41
0.562
LON-WEI-adc59df6-13
0.562
LON-WEI-adc59df6-2
0.561
LON-WEI-adc59df6-28
0.558
BRU-LEF-973da26b-1
0.558
LON-WEI-adc59df6-39
0.557
LON-WEI-adc59df6-38
0.556
LON-WEI-adc59df6-11
0.553
NIM-NMI-8bb27a2b-22
0.552
LON-WEI-adc59df6-7
0.550
LON-WEI-adc59df6-10
0.546
LON-WEI-adc59df6-36
0.546
LON-WEI-adc59df6-40
0.546
LON-WEI-b8d98729-47
0.541
NIM-NMI-8bb27a2b-25
0.540
LON-WEI-adc59df6-6
0.539
LON-WEI-b8d98729-36
0.538
BRU-LEF-8bac3ce8-1
0.536
LON-WEI-b8d98729-12
0.535
LON-WEI-adc59df6-20
0.535
LON-WEI-b8d98729-35
0.530
LON-WEI-b8d98729-19
0.530
LON-WEI-adc59df6-23
0.530
LON-WEI-adc59df6-47
0.529
LON-POS-586a7c45-1
0.529
LON-WEI-adc59df6-32
0.529
PAU-WEI-5b8d5051-1
0.529
RAL-MED-9a5eb9cb-10
0.527
ERI-UCB-fbdd3ea1-4
0.527
RAL-MED-9a5eb9cb-12
0.527
LON-WEI-adc59df6-82
0.526
LON-WEI-b8d98729-33
0.525
LON-WEI-adc59df6-22
0.525
LON-WEI-d1c9908a-5
0.525
RAL-MED-9a5eb9cb-9
0.521
LON-WEI-adc59df6-91
0.521
NIM-NMI-8bb27a2b-21
0.520
NIM-NMI-8bb27a2b-19
0.515
LON-WEI-b8d98729-39
0.515
ERI-UCB-fbdd3ea1-1
0.515
LON-WEI-8f408cad-10
0.515
LON-WEI-adc59df6-19
0.515
ERI-UCB-fbdd3ea1-2
0.515
LON-WEI-adc59df6-25
0.510
LON-WEI-adc59df6-58
0.505
NIM-NMI-8bb27a2b-17
0.500
NIM-NMI-8bb27a2b-26
0.495
NIM-NMI-8bb27a2b-18
0.495
NIM-NMI-8bb27a2b-23
0.495
LON-WEI-b8d98729-10
0.495
LON-WEI-b8d98729-13
0.490
NIM-NMI-8bb27a2b-24
0.485
LON-WEI-adc59df6-80
0.484
RAL-MED-9a5eb9cb-4
0.481
LON-WEI-adc59df6-87
0.480