Molecular Properties | |
SMILES: | C=CC(=O)N(c1ccc(C(F)(F)F)cc1)C(C(=O)NC1CC1)c1cccnc1 |
MW: | 389.14 |
Fraction sp3: | 0.25 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 62.3 |
cLogP: | 3.64 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Long aliphatic chain
AAR-POS-d2a4d1df-11
RAL-MED-9a5eb9cb-15
0.889
NIM-NMI-8bb27a2b-15
0.865
LON-WEI-adc59df6-44
0.819
LON-WEI-adc59df6-14
0.750
RAL-MED-9a5eb9cb-10
0.740
LON-WEI-adc59df6-35
0.731
LON-WEI-adc59df6-8
0.713
RAL-MED-9a5eb9cb-12
0.711
ERI-UCB-fbdd3ea1-4
0.711
RAL-MED-9a5eb9cb-9
0.696
LON-WEI-adc59df6-39
0.695
RAL-MED-9a5eb9cb-11
0.671
BRU-LEF-8bac3ce8-1
0.671
NIM-NMI-8bb27a2b-22
0.671
NIM-NMI-8bb27a2b-19
0.667
NIM-NMI-8bb27a2b-24
0.667
LON-WEI-b8d98729-41
0.663
NIM-NMI-8bb27a2b-16
0.659
LON-WEI-b8d98729-27
0.647
NIM-NMI-8bb27a2b-18
0.635
NIM-NMI-8bb27a2b-20
0.635
NIM-NMI-8bb27a2b-23
0.635
NIM-NMI-8bb27a2b-25
0.632
LON-WEI-adc59df6-6
0.629
LON-WEI-adc59df6-1
0.628
NIM-NMI-8bb27a2b-21
0.625
NIM-NMI-8bb27a2b-28
0.621
ERI-UCB-fbdd3ea1-2
0.618
ERI-UCB-fbdd3ea1-1
0.618
LON-WEI-b8d98729-39
0.618
NIM-NMI-8bb27a2b-26
0.611
LON-WEI-b8d98729-37
0.604
LON-WEI-adc59df6-3
0.603
LON-WEI-adc59df6-21
0.600
LON-WEI-adc59df6-15
0.596
LON-WEI-babf2c61-9
0.593
LON-WEI-8f408cad-8
0.588
NIM-NMI-8bb27a2b-27
0.587
LON-WEI-adc59df6-91
0.576
LON-WEI-adc59df6-30
0.573
LON-WEI-adc59df6-31
0.565
LON-WEI-adc59df6-41
0.557
LON-WEI-adc59df6-26
0.552
LON-WEI-adc59df6-42
0.552
NIM-NMI-8bb27a2b-3
0.552
LON-WEI-adc59df6-29
0.547
LON-WEI-adc59df6-82
0.547
LON-WEI-adc59df6-46
0.538
JAN-GHE-d851b096-7
0.538
LON-WEI-adc59df6-80
0.536
LON-WEI-adc59df6-17
0.534
LON-WEI-d1c9908a-7
0.533
LON-WEI-adc59df6-36
0.533
LON-WEI-adc59df6-5
0.533
LON-WEI-adc59df6-19
0.532
LON-WEI-adc59df6-32
0.532
LON-WEI-b8d98729-7
0.529
LON-WEI-adc59df6-28
0.528
LON-WEI-adc59df6-34
0.527
LON-WEI-adc59df6-37
0.527
LON-WEI-adc59df6-33
0.527
LON-WEI-adc59df6-27
0.522
RIT-AID-af4ac3d4-1
0.522
LON-WEI-adc59df6-18
0.522
LON-WEI-adc59df6-16
0.521
LON-WEI-d1c9908a-9
0.521
LON-WEI-d1c9908a-1
0.517
LON-WEI-adc59df6-10
0.516
LON-WEI-adc59df6-40
0.516
ERI-UCB-fbdd3ea1-7
0.516
LON-WEI-b8d98729-35
0.516
LON-WEI-adc59df6-23
0.516
LON-WEI-b8d98729-6
0.512
ALP-POS-88a7a97e-12
0.511
LON-WEI-adc59df6-22
0.511
LON-WEI-adc59df6-9
0.511
LON-WEI-adc59df6-12
0.511
LON-WEI-b8d98729-33
0.511
RAL-MED-9a5eb9cb-4
0.511
LON-WEI-d1c9908a-10
0.511
LON-WEI-d1c9908a-12
0.511
LON-WEI-adc59df6-24
0.510
ERI-UCB-fbdd3ea1-15
0.506
LON-WEI-adc59df6-20
0.505
ERI-UCB-fbdd3ea1-6
0.505
LON-WEI-adc59df6-4
0.505
LON-WEI-adc59df6-43
0.505
LON-WEI-adc59df6-45
0.505
LON-WEI-adc59df6-47
0.500
LON-WEI-adc59df6-95
0.500
LON-POS-586a7c45-1
0.500
LON-WEI-adc59df6-2
0.500
PAU-WEI-5b8d5051-1
0.500
LON-WEI-adc59df6-83
0.500
LON-WEI-d1c9908a-3
0.500
LON-WEI-adc59df6-11
0.495
LON-WEI-b8d98729-36
0.495
LON-WEI-adc59df6-25
0.495
NIM-NMI-8bb27a2b-1
0.495
ERI-UCB-fbdd3ea1-5
0.495