Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(C)(C)C)cc1)C(C(=O)Nc1ccc(OC)nc1)c1cccnc1 |
MW: | 444.535 |
Fraction sp3: | 0.23 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 84.42 |
cLogP: | 4.6817 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2020-05-13 |
AAR-POS-d2a4d1df-1
LON-WEI-d1c9908a-7
0.741
LON-WEI-adc59df6-41
0.709
LON-WEI-adc59df6-12
0.708
ALP-POS-88a7a97e-41
0.681
LON-WEI-adc59df6-18
0.667
LON-WEI-adc59df6-3
0.667
LON-WEI-adc59df6-24
0.649
LON-WEI-adc59df6-46
0.648
RIT-AID-af4ac3d4-1
0.648
LON-WEI-adc59df6-14
0.644
LON-WEI-adc59df6-5
0.641
LON-WEI-adc59df6-44
0.640
LON-WEI-adc59df6-30
0.635
LON-WEI-adc59df6-15
0.634
LON-WEI-8f408cad-8
0.631
LON-WEI-b8d98729-27
0.630
LON-WEI-adc59df6-26
0.629
LON-WEI-adc59df6-35
0.629
LON-WEI-adc59df6-42
0.629
LON-WEI-adc59df6-4
0.625
LON-WEI-adc59df6-43
0.625
LON-WEI-adc59df6-21
0.624
LON-WEI-d1c9908a-3
0.621
LON-WEI-adc59df6-13
0.620
LON-WEI-adc59df6-8
0.615
LON-WEI-adc59df6-27
0.615
LON-WEI-adc59df6-11
0.612
LON-WEI-adc59df6-45
0.608
LON-WEI-adc59df6-29
0.607
LON-WEI-adc59df6-28
0.604
LON-WEI-adc59df6-38
0.596
LON-WEI-adc59df6-16
0.594
LON-WEI-adc59df6-17
0.593
LON-WEI-adc59df6-36
0.591
LON-WEI-adc59df6-40
0.591
LON-WEI-b8d98729-35
0.589
LON-WEI-adc59df6-23
0.589
LON-WEI-adc59df6-31
0.589
BRU-LEF-973da26b-1
0.587
LON-WEI-adc59df6-39
0.585
LON-WEI-b8d98729-33
0.583
LON-WEI-adc59df6-34
0.583
LON-WEI-d1c9908a-10
0.583
NIM-NMI-8bb27a2b-25
0.583
LON-WEI-adc59df6-9
0.583
LON-WEI-adc59df6-33
0.583
RAL-MED-9a5eb9cb-9
0.582
LON-WEI-adc59df6-20
0.579
LON-WEI-adc59df6-1
0.579
LON-WEI-d1c9908a-9
0.577
LON-WEI-adc59df6-10
0.574
LON-WEI-adc59df6-2
0.573
LON-WEI-adc59df6-19
0.571
LON-WEI-b8d98729-47
0.568
LON-WEI-adc59df6-6
0.566
BRU-LEF-8bac3ce8-1
0.564
LON-WEI-b8d98729-12
0.562
LON-WEI-adc59df6-7
0.561
RAL-MED-9a5eb9cb-10
0.557
LON-WEI-adc59df6-32
0.556
LON-WEI-adc59df6-22
0.551
LON-WEI-d1c9908a-5
0.551
NIM-NMI-8bb27a2b-19
0.543
LON-WEI-b8d98729-22
0.541
LON-WEI-adc59df6-47
0.540
LON-POS-586a7c45-1
0.540
PAU-WEI-5b8d5051-1
0.540
ERI-UCB-fbdd3ea1-4
0.538
RAL-MED-9a5eb9cb-12
0.538
LON-WEI-d1c9908a-12
0.535
LON-WEI-adc59df6-25
0.535
NIM-NMI-8bb27a2b-26
0.535
NIM-NMI-8bb27a2b-22
0.531
LON-WEI-b8d98729-37
0.529
NIM-NMI-8bb27a2b-17
0.527
LON-WEI-b8d98729-41
0.526
JAN-GHE-d851b096-4
0.526
LON-WEI-b8d98729-24
0.526
LON-WEI-adc59df6-82
0.521
RAL-MED-9a5eb9cb-15
0.521
NIM-NMI-8bb27a2b-23
0.520
LON-WEI-adc59df6-91
0.516
LON-WEI-d1c9908a-11
0.515
NIM-NMI-8bb27a2b-24
0.510
NIM-NMI-8bb27a2b-15
0.510
LON-WEI-d1c9908a-2
0.510
LON-WEI-b8d98729-10
0.505
NIM-NMI-8bb27a2b-16
0.505
NIM-NMI-8bb27a2b-18
0.505
RAL-MED-9a5eb9cb-4
0.505
NIM-NMI-8bb27a2b-21
0.500
LON-WEI-b8d98729-25
0.495
LON-WEI-b8d98729-39
0.495
LON-WEI-8f408cad-10
0.495
ERI-UCB-fbdd3ea1-1
0.495
ERI-UCB-fbdd3ea1-2
0.495
LON-WEI-b8d98729-19
0.495
LON-WEI-adc59df6-80
0.495
LON-WEI-b8d98729-17
0.491
LON-WEI-b8d98729-36
0.491