Molecular Properties | |
SMILES: | CC(C)(C)c1ccc(N(C(=O)c2ccc(Cl)o2)C(C(=O)NCCc2cccc(F)c2)c2cccnc2)cc1 |
MW: | 533.19 |
Fraction sp3: | 0.23 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 8 |
TPSA: | 75.44 |
cLogP: | 6.51 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.314847770015297 |
IC50 (µM) - RapidFire: | 0.514712537176535 |
Order Status | |
Ordered: | 2020-09-07 |
Synthesis Location: | order |
Shipped: | 2020-09-22 |
Long aliphatic chain
ALP-POS-95f71980-6
0.798
LON-WEI-2e27a2e5-1
0.763
MAT-POS-f2460aef-2
0.763
MAT-POS-f2460aef-1
0.763
ALP-POS-95f71980-21
0.763
ALP-POS-305f6ec3-49
0.747
ALP-POS-02c6a514-11
0.742
ALP-POS-95f71980-18
0.737
LON-WEI-2e27a2e5-2
0.731
ALP-POS-305f6ec3-4
0.730
ALP-POS-02c6a514-12
0.729
ALP-POS-95f71980-4
0.711
ALP-POS-02c6a514-26
0.708
ALP-POS-305f6ec3-44
0.704
ALP-POS-305f6ec3-41
0.704
ALP-POS-95f71980-2
0.701
ALP-POS-95f71980-17
0.701
ALP-POS-305f6ec3-3
0.700
ALP-POS-305f6ec3-40
0.700
ALP-POS-95f71980-25
0.697
ALP-POS-305f6ec3-14
0.697
ALP-POS-02c6a514-25
0.697
ALP-POS-02c6a514-50
0.697
ALP-POS-02c6a514-52
0.694
ALP-POS-305f6ec3-59
0.694
ALP-POS-95f71980-23
0.690
PAU-WEI-5b8d5051-2
0.688
LON-WEI-adc59df6-47
0.688
PAU-WEI-5b8d5051-1
0.688
LON-POS-586a7c45-1
0.688
PET-UNK-48ab5cd7-2
0.687
ALP-POS-305f6ec3-27
0.687
ALP-POS-305f6ec3-46
0.687
PET-UNK-48ab5cd7-3
0.687
ALP-POS-02c6a514-22
0.687
MAT-POS-f2460aef-3
0.680
MAT-POS-f2460aef-5
0.680
ALP-POS-305f6ec3-6
0.680
ALP-POS-305f6ec3-48
0.680
ALP-POS-305f6ec3-55
0.680
PET-UNK-48ab5cd7-1
0.680
ALP-POS-02c6a514-49
0.680
ALP-POS-95f71980-22
0.680
ALP-POS-95f71980-24
0.680
ALP-POS-02c6a514-46
0.680
ALP-POS-02c6a514-6
0.680
ALP-POS-95f71980-7
0.680
ALP-POS-305f6ec3-18
0.679
PET-UNK-7d68125a-4
0.673
ALP-POS-95f71980-29
0.673
ALP-POS-02c6a514-33
0.673
ALP-POS-305f6ec3-2
0.673
ALP-POS-305f6ec3-56
0.673
ALP-POS-02c6a514-40
0.670
ALP-POS-305f6ec3-19
0.670
PET-UNK-7d68125a-3
0.667
ALP-POS-305f6ec3-38
0.667
ALP-POS-305f6ec3-39
0.667
ALP-POS-305f6ec3-52
0.667
PET-UNK-7d68125a-2
0.667
ALP-POS-305f6ec3-35
0.663
ALP-POS-305f6ec3-30
0.661
ALP-POS-305f6ec3-28
0.660
ALP-POS-305f6ec3-57
0.660
ALP-POS-305f6ec3-33
0.660
JOE-NOR-4e4adc6b-1
0.660
ALP-POS-305f6ec3-54
0.654
ALP-POS-305f6ec3-20
0.654
ALP-POS-305f6ec3-50
0.654
PET-UNK-7d68125a-1
0.653
ALP-POS-305f6ec3-42
0.651
ALP-POS-305f6ec3-7
0.648
ALP-POS-305f6ec3-36
0.648
ALP-POS-305f6ec3-12
0.648
ALP-POS-305f6ec3-23
0.648
ALP-UNI-c3ef0aba-3
0.647
PET-UNK-48ab5cd7-6
0.644
ALP-POS-305f6ec3-17
0.642
ALP-POS-305f6ec3-51
0.642
ALP-POS-305f6ec3-45
0.639
ALP-POS-305f6ec3-10
0.639
ALP-POS-305f6ec3-16
0.639
ALP-POS-02c6a514-17
0.638
ALF-EVA-719172df-6
0.636
ALP-POS-305f6ec3-1
0.633
ALP-POS-95f71980-11
0.633
ALP-POS-305f6ec3-47
0.631
ALP-POS-02c6a514-45
0.630
ALP-POS-305f6ec3-5
0.624
ALP-POS-02c6a514-51
0.623
ALP-UNI-fe744232-18
0.619
ALP-POS-95f71980-36
0.617
ALP-POS-02c6a514-38
0.614
ALP-POS-b0bc6a46-23
0.614
ALP-POS-305f6ec3-22
0.612
ALP-POS-305f6ec3-8
0.611
ALP-POS-305f6ec3-24
0.611
ALP-POS-305f6ec3-9
0.605
WIL-UNI-354943b6-10
0.604
ALP-POS-305f6ec3-11
0.603