Molecular Properties | |
SMILES: | O=C(Cc1cc(Cl)ccc1F)Nc1cncc2ccccc12 |
MW: | 314.06 |
Fraction sp3: | 0.06 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 41.99 |
cLogP: | 4.21 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.706793757909663 |
IC50 (µM) - RapidFire: | 0.75999776205801 |
Order Status | |
Shipped: | 2021-01-20 |
PET-UNK-dd44aeb6-1
1.000
RAL-THA-2d450e86-26
0.746
RAL-THA-2d450e86-24
0.710
RAL-THA-2d450e86-27
0.710
PET-UNK-dd44aeb6-2
0.710
RAL-THA-2d450e86-37
0.672
MIC-UNK-df9dcda8-3
0.671
MIC-UNK-df9dcda8-4
0.667
MAT-POS-3b92565d-1
0.662
BEN-DND-d1eb1f41-4
0.662
MAT-POS-bbbbc21a-1
0.662
RAL-THA-2d450e86-29
0.662
PET-UNK-dd44aeb6-3
0.662
RAL-THA-2d450e86-28
0.662
BEN-DND-d1eb1f41-6
0.653
MIC-UNK-df9dcda8-1
0.636
VLA-UNK-b9c208fe-2
0.634
MIC-UNK-df9dcda8-2
0.633
RAL-THA-2d450e86-6
0.630
RAL-THA-2d450e86-2
0.623
RAL-THA-2d450e86-36
0.623
VLA-UNK-9a7dc93f-1
0.622
ALP-POS-6479a3a9-2
0.620
ADA-UCB-6c2cb422-1
0.620
RAL-THA-2d450e86-19
0.616
RAL-THA-2d450e86-30
0.614
MAT-POS-fce787c2-2
0.614
RAL-THA-2d450e86-14
0.608
RAL-THA-2d450e86-9
0.608
ALP-POS-df536be7-6
0.605
ALP-POS-d7944b10-1
0.605
ALP-POS-d7944b10-2
0.605
ALP-POS-6479a3a9-3
0.605
MAK-UNK-919546f0-4
0.603
RAL-THA-2d450e86-23
0.603
NAU-LAT-2fed8305-9
0.597
RAL-THA-2d450e86-33
0.597
MAT-POS-bbbbc21a-3
0.593
RAL-THA-2d450e86-35
0.592
RAL-THA-2d450e86-16
0.592
MAT-POS-afd4d4fd-3
0.589
RAL-THA-2d450e86-34
0.589
PET-UNK-3c72d439-1
0.587
ALP-POS-d7944b10-16
0.583
NAU-LAT-2fed8305-5
0.581
PET-UNK-bb7ffe78-1
0.579
RAL-THA-2d450e86-7
0.577
RAL-THA-2d450e86-38
0.577
MIC-UNK-16ccb665-3
0.577
ALP-POS-d7944b10-7
0.576
MAT-POS-23a8a11a-1
0.575
RAL-THA-2d450e86-10
0.575
MAT-POS-afd4d4fd-1
0.573
RAL-THA-2d450e86-20
0.573
RAL-THA-2d450e86-21
0.571
ALP-POS-d7944b10-12
0.570
ALP-POS-d7944b10-17
0.570
MIC-UNK-06e5f114-1
0.570
NAU-LAT-30527ac5-1
0.568
MAK-UNK-c749d764-11
0.566
RAL-THA-2d450e86-15
0.566
RAL-THA-2d450e86-1
0.565
MIC-UNK-37660950-2
0.563
ALP-POS-df536be7-5
0.562
RAL-THA-1d44ff04-3
0.562
MAK-UNK-c749d764-32
0.558
PET-UNK-bb7ffe78-3
0.557
ALP-POS-d7944b10-8
0.557
VLA-UNK-b9c208fe-1
0.556
MIC-UNK-644c43c7-4
0.554
NAU-LAT-2fed8305-6
0.554
RAL-THA-2d450e86-22
0.551
ALP-POS-d7944b10-6
0.551
ALP-POS-d7944b10-10
0.551
VLA-UNK-9a7dc93f-2
0.550
ALP-POS-d7944b10-13
0.549
PET-UNK-bb7ffe78-2
0.549
RAL-THA-1d44ff04-6
0.549
RAL-THA-1d44ff04-9
0.549
MIC-UNK-644c43c7-3
0.548
MAT-POS-afd4d4fd-2
0.547
RAL-THA-2d450e86-39
0.547
RAL-THA-2d450e86-40
0.547
RAL-THA-2d450e86-8
0.545
ALP-POS-d7944b10-15
0.544
ALP-POS-d7944b10-14
0.544
MIC-UNK-e7433122-1
0.544
RAL-THA-1d44ff04-4
0.544
ALP-POS-3b848b35-1
0.544
MAT-POS-3b92565d-2
0.544
RAL-THA-2d450e86-18
0.544
PET-UNK-8c422e11-1
0.543
RAL-THA-2d450e86-3
0.542
RAL-THA-2d450e86-4
0.541
MIC-UNK-06e5f114-2
0.538
MIC-UNK-37660950-1
0.538
ALP-POS-d7944b10-5
0.538
ALP-POS-f13221e1-2
0.538
MAT-POS-cc05818f-1
0.537
RAL-THA-2d450e86-17
0.537