Molecular Properties | |
SMILES: | CN1C(=O)CCc2cc(N(C(=O)c3c[nH]cn3)C(C(=O)NCCc3cccc(F)c3)c3cccnc3)ccc21 |
MW: | 526.21 |
Fraction sp3: | 0.21 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 8 |
TPSA: | 111.29 |
cLogP: | 3.6 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.0 |
Order Status | |
Shipped: | synthesis in progress |
Long aliphatic chain
MAT-POS-f2460aef-1
ALP-POS-ced8ea4d-1
0.811
BRU-THA-92256091-77
0.783
ALP-POS-e980f4ea-1
0.777
BRU-THA-92256091-54
0.690
BRU-THA-92256091-55
0.669
WIL-UNI-354943b6-2
0.661
BRU-THA-92256091-51
0.658
MAT-POS-f2460aef-3
0.658
ALP-POS-1245c3fa-1
0.655
BRU-THA-92256091-24
0.655
ALP-POS-1245c3fa-2
0.652
BRU-THA-92256091-8
0.651
WIL-UNI-354943b6-7
0.649
BRU-THA-92256091-22
0.649
BRU-THA-92256091-76
0.648
BRU-THA-92256091-18
0.646
WIL-UNI-354943b6-10
0.646
BRU-THA-92256091-42
0.641
BRU-THA-92256091-62
0.641
BRU-THA-92256091-52
0.639
BRU-THA-92256091-85
0.638
BRU-THA-92256091-15
0.637
BRU-THA-92256091-19
0.637
BRU-THA-92256091-59
0.636
BRU-THA-92256091-61
0.636
WIL-UNI-354943b6-3
0.635
BRU-THA-92256091-67
0.633
BRU-THA-92256091-32
0.632
BRU-THA-92256091-65
0.630
BRU-THA-92256091-64
0.630
BRU-THA-92256091-21
0.629
WIL-UNI-354943b6-1
0.627
ALP-POS-ced8ea4d-30
0.627
BRU-THA-92256091-23
0.626
BRU-THA-92256091-30
0.626
BRU-THA-92256091-31
0.626
BRU-THA-92256091-60
0.625
BRU-THA-92256091-80
0.624
WIL-UNI-354943b6-12
0.624
WIL-UNI-354943b6-8
0.624
BRU-THA-92256091-79
0.622
BRU-THA-92256091-14
0.621
BRU-THA-92256091-16
0.621
BRU-THA-92256091-17
0.621
BRU-THA-92256091-20
0.621
BRU-THA-92256091-66
0.620
WIL-UNI-354943b6-9
0.619
BRU-THA-92256091-75
0.615
WIL-UNI-354943b6-5
0.615
BRU-THA-92256091-44
0.615
BRU-THA-92256091-83
0.612
WIL-UNI-354943b6-14
0.610
BRU-THA-92256091-86
0.608
WIL-UNI-354943b6-11
0.603
WIL-UNI-354943b6-4
0.603
WIL-UNI-354943b6-13
0.603
BRU-THA-92256091-63
0.602
BRU-THA-92256091-68
0.602
ALP-POS-e980f4ea-30
0.598
WIL-UNI-354943b6-6
0.593
BRU-THA-92256091-92
0.589
BRU-THA-92256091-91
0.584
BRU-THA-92256091-93
0.581
BRU-THA-92256091-84
0.575
BRU-THA-92256091-12
0.574
ALP-POS-ced8ea4d-53
0.560
BRU-THA-92256091-11
0.553
BRU-THA-92256091-88
0.548
ALP-POS-ced8ea4d-47
0.539
BRU-THA-92256091-7
0.538
BRU-THA-92256091-2
0.537
ALP-POS-95f71980-17
0.534
ALP-POS-305f6ec3-33
0.533
BRU-THA-92256091-33
0.528
BRU-THA-92256091-13
0.525
BRU-THA-92256091-9
0.525
ALP-POS-305f6ec3-12
0.524
ALP-POS-ced8ea4d-24
0.523
ALP-POS-ced8ea4d-25
0.523
BRU-THA-92256091-6
0.521
ALP-POS-305f6ec3-14
0.521
ALP-POS-02c6a514-50
0.521
ALP-POS-305f6ec3-57
0.520
ALP-UNI-fe744232-3
0.520
BRU-THA-92256091-5
0.520
BRU-THA-92256091-25
0.520
BRU-THA-92256091-3
0.520
ALP-POS-95f71980-10
0.519
ALP-POS-305f6ec3-2
0.516
ALP-POS-305f6ec3-50
0.516
ALP-POS-e980f4ea-53
0.516
BRU-THA-92256091-73
0.515
ALP-POS-95f71980-34
0.515
ALP-POS-305f6ec3-27
0.512
ALP-POS-305f6ec3-46
0.512
ALP-POS-02c6a514-22
0.512
ALP-POS-ced8ea4d-27
0.512
BRU-THA-92256091-27
0.512
ALP-UNI-fe744232-18
0.512
ALP-POS-780445ae-6
0.512