Molecular Properties | |
SMILES: | O=C(NCCc1cccc(F)c1)C(c1cccnc1)N(C(=O)c1cocn1)C1COc2ccccc2C1 |
MW: | 500.19 |
Fraction sp3: | 0.21 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 8 |
TPSA: | 97.56 |
cLogP: | 3.75 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
Order Status | |
Shipped: | synthesis in progress |
Long aliphatic chain
BRU-THA-92256091-58
0.802
ALP-POS-e980f4ea-4
0.737
ALP-POS-ced8ea4d-13
0.700
ALP-POS-ced8ea4d-22
0.700
ALP-POS-ced8ea4d-66
0.688
ALP-POS-ced8ea4d-14
0.675
ALP-POS-ced8ea4d-42
0.675
ALP-POS-ced8ea4d-2
0.667
ALP-POS-ced8ea4d-29
0.664
ALP-POS-ced8ea4d-55
0.661
ALP-POS-ced8ea4d-43
0.658
ALP-POS-ced8ea4d-57
0.655
ALP-POS-ced8ea4d-45
0.655
ALP-POS-ced8ea4d-56
0.650
ALP-POS-ced8ea4d-61
0.647
ALP-POS-ced8ea4d-6
0.639
ALP-POS-ced8ea4d-31
0.636
ALP-POS-ced8ea4d-60
0.636
ALP-POS-ced8ea4d-33
0.630
ALP-POS-ced8ea4d-23
0.628
MIC-UNK-8686cf1d-1
0.617
ALP-POS-ced8ea4d-26
0.616
ALP-POS-ced8ea4d-3
0.589
ALP-POS-ced8ea4d-7
0.584
ALP-POS-ced8ea4d-64
0.583
ALP-POS-ced8ea4d-28
0.560
ALP-POS-ced8ea4d-41
0.558
ALP-POS-ced8ea4d-54
0.555
MIC-UNK-8686cf1d-5
0.551
ALP-POS-95f71980-14
0.550
ALP-POS-ced8ea4d-63
0.549
ALP-POS-95f71980-9
0.546
ALP-POS-ced8ea4d-62
0.545
ALP-POS-95f71980-13
0.541
ALP-POS-95f71980-16
0.541
ALP-POS-ced8ea4d-58
0.540
ALP-POS-ced8ea4d-27
0.538
BRU-THA-92256091-9
0.537
BRU-THA-92256091-2
0.537
BRU-THA-92256091-13
0.537
BRU-THA-92256091-1
0.537
ALP-POS-95f71980-1
0.537
ALP-POS-95f71980-3
0.536
ALP-POS-ced8ea4d-53
0.535
ALP-POS-ced8ea4d-25
0.534
ALP-POS-02c6a514-50
0.533
ALP-POS-ced8ea4d-37
0.533
ALP-POS-95f71980-39
0.532
BRU-THA-92256091-10
0.532
BRU-THA-92256091-39
0.532
ALP-POS-ced8ea4d-59
0.532
ALP-POS-95f71980-40
0.532
BRU-THA-92256091-70
0.531
ALP-POS-ced8ea4d-9
0.529
BRU-THA-92256091-40
0.528
ALP-POS-ced8ea4d-47
0.527
ALP-UNI-fe744232-18
0.525
ALP-POS-ced8ea4d-19
0.525
ALP-POS-95f71980-20
0.524
ALP-POS-ced8ea4d-40
0.524
BRU-THA-92256091-35
0.524
ALP-POS-ced8ea4d-67
0.520
ALP-UNI-fe744232-3
0.520
BRU-THA-92256091-3
0.520
BRU-THA-92256091-5
0.520
ALP-POS-95f71980-5
0.520
MIC-UNK-8686cf1d-7
0.520
BRU-THA-92256091-50
0.520
BRU-THA-92256091-29
0.520
ALP-UNI-fe744232-14
0.516
ALP-POS-ced8ea4d-49
0.516
ALP-POS-ced8ea4d-52
0.516
ALP-POS-ced8ea4d-5
0.516
ALP-POS-ced8ea4d-11
0.516
ALP-POS-ced8ea4d-39
0.516
BRU-THA-92256091-33
0.516
ALP-UNI-fe744232-22
0.516
ALP-POS-ced8ea4d-46
0.516
BRU-THA-92256091-81
0.516
BRU-THA-92256091-82
0.516
BRU-THA-92256091-48
0.515
ALP-POS-95f71980-34
0.515
ALP-POS-95f71980-27
0.515
ALP-UNI-fe744232-9
0.512
ALP-POS-ced8ea4d-51
0.512
BRU-THA-92256091-38
0.512
ALP-POS-ced8ea4d-12
0.512
ALP-POS-95f71980-36
0.512
ALP-POS-ced8ea4d-17
0.512
ALP-POS-95f71980-26
0.512
ALP-POS-ced8ea4d-35
0.512
ALP-POS-95f71980-31
0.508
ALP-POS-95f71980-37
0.508
ALP-UNI-fe744232-12
0.508
BRU-THA-92256091-25
0.508
BRU-THA-92256091-69
0.508
BRU-THA-92256091-57
0.508
BRU-THA-92256091-72
0.508
BRU-THA-92256091-49
0.508
BRU-THA-92256091-74
0.508